bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine

C240H361Cl4F8N21O5 — CID 159678693

IUPACbis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine
SMILESC.C.C.C.C.C.C.C.C.C.C.CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(OCC(F)(F)F)cn1.CC(C)c1ccccc1Cl.CC(C)c1cccnc1.CC(C)c1cccnc1F.CC(C)c1ccncc1.CCc1cc(C(C)C)ccn1.CCc1cncc(C(C)C)c1.CCc1ncccc1C(C)C.COc1ccc(C(C)C)c(F)c1.COc1ccc(C(C)C)cc1.COc1ccc(C(C)C)cn1.Cc1cc(C(C)C)ccn1.Cc1cc(C(C)C)ccn1.Cc1cc(C(C)C)cnc1Cl.Cc1cc(C(C)C)cnc1Cl.Cc1ccc(C(C)C)c(C)n1.Cc1ccc(C(C)C)cn1.Cc1cnc(C)c(C(C)C)c1.Cc1cncc(C(C)C)c1F.Cc1nc(C(C)C)ccc1F.Cc1ncc(F)cc1C(C)C.Cc1ncccc1C(C)C.Cc1ncccc1C(C)C
InChIInChI=1S/C10H12F3NO.C10H13FO.5C10H15N.C10H14O.2C9H12ClN.2C9H11Cl.3C9H12FN.C9H13NO.5C9H13N.C8H10FN.C8H11NO.2C8H11N.11CH4/c1-7(2)9-4-3-8(5-14-9)15-6-10(11,12)13;1-7(2)9-5-4-8(12-3)6-10(9)11;1-7(2)10-5-8(3)6-11-9(10)4;1-7(2)10-6-5-8(3)11-9(10)4;1-4-9-5-10(8(2)3)7-11-6-9;1-4-10-7-9(8(2)3)5-6-11-10;1-4-10-9(8(2)3)6-5-7-11-10;1-8(2)9-4-6-10(11-3)7-5-9;2*1-6(2)8-4-7(3)9(10)11-5-8;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-5-3-4-6-9(8)10;1-6(2)9-4-8(10)5-11-7(9)3;1-6(2)8-5-11-4-7(3)9(8)10;1-6(2)9-5-4-8(10)7(3)11-9;1-7(2)8-4-5-9(11-3)10-6-8;2*1-7(2)9-4-5-10-8(3)6-9;1-7(2)9-5-4-8(3)10-6-9;2*1-7(2)9-5-4-6-10-8(9)3;1-6(2)7-4-3-5-10-8(7)9;1-6(2)7-3-4-8(10)9-5-7;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;;;;;;;;;;;/h3-5,7H,6H2,1-2H3;4-7H,1-3H3;2*5-7H,1-4H3;3*5-8H,4H2,1-3H3;4-8H,1-3H3;2*4-6H,1-3H3;2*3-7H,1-2H3;3*4-6H,1-3H3;4-7H,1-3H3;5*4-7H,1-3H3;3-6H,1-2H3;3-6H,1-2H3,(H,9,10);2*3-7H,1-2H3;11*1H4
InChIKeyMUYAQMMOUAEIHB-UHFFFAOYSA-N
MW3914.47 g/mol
LogP74.12
Rot. Bonds33

About bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine

bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine (PubChem CID 159678693) has the molecular formula C240H361Cl4F8N21O5 and a molecular weight of 3914.47 g/mol. Its IUPAC name is bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine.

Molecular Properties

Compound Namebis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine
PubChem CID159678693
Molecular FormulaC240H361Cl4F8N21O5
Molecular Weight3914.47 g/mol
Exact Mass3909.73
IUPAC Namebis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine
SMILESC.C.C.C.C.C.C.C.C.C.C.CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(OCC(F)(F)F)cn1.CC(C)c1ccccc1Cl.CC(C)c1cccnc1.CC(C)c1cccnc1F.CC(C)c1ccncc1.CCc1cc(C(C)C)ccn1.CCc1cncc(C(C)C)c1.CCc1ncccc1C(C)C.COc1ccc(C(C)C)c(F)c1.COc1ccc(C(C)C)cc1.COc1ccc(C(C)C)cn1.Cc1cc(C(C)C)ccn1.Cc1cc(C(C)C)ccn1.Cc1cc(C(C)C)cnc1Cl.Cc1cc(C(C)C)cnc1Cl.Cc1ccc(C(C)C)c(C)n1.Cc1ccc(C(C)C)cn1.Cc1cnc(C)c(C(C)C)c1.Cc1cncc(C(C)C)c1F.Cc1nc(C(C)C)ccc1F.Cc1ncc(F)cc1C(C)C.Cc1ncccc1C(C)C.Cc1ncccc1C(C)C
InChIInChI=1S/C10H12F3NO.C10H13FO.5C10H15N.C10H14O.2C9H12ClN.2C9H11Cl.3C9H12FN.C9H13NO.5C9H13N.C8H10FN.C8H11NO.2C8H11N.11CH4/c1-7(2)9-4-3-8(5-14-9)15-6-10(11,12)13;1-7(2)9-5-4-8(12-3)6-10(9)11;1-7(2)10-5-8(3)6-11-9(10)4;1-7(2)10-6-5-8(3)11-9(10)4;1-4-9-5-10(8(2)3)7-11-6-9;1-4-10-7-9(8(2)3)5-6-11-10;1-4-10-9(8(2)3)6-5-7-11-10;1-8(2)9-4-6-10(11-3)7-5-9;2*1-6(2)8-4-7(3)9(10)11-5-8;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-5-3-4-6-9(8)10;1-6(2)9-4-8(10)5-11-7(9)3;1-6(2)8-5-11-4-7(3)9(8)10;1-6(2)9-5-4-8(10)7(3)11-9;1-7(2)8-4-5-9(11-3)10-6-8;2*1-7(2)9-4-5-10-8(3)6-9;1-7(2)9-5-4-8(3)10-6-9;2*1-7(2)9-5-4-6-10-8(9)3;1-6(2)7-4-3-5-10-8(7)9;1-6(2)7-3-4-8(10)9-5-7;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;;;;;;;;;;;/h3-5,7H,6H2,1-2H3;4-7H,1-3H3;2*5-7H,1-4H3;3*5-8H,4H2,1-3H3;4-8H,1-3H3;2*4-6H,1-3H3;2*3-7H,1-2H3;3*4-6H,1-3H3;4-7H,1-3H3;5*4-7H,1-3H3;3-6H,1-2H3;3-6H,1-2H3,(H,9,10);2*3-7H,1-2H3;11*1H4
InChIKeyMUYAQMMOUAEIHB-UHFFFAOYSA-N
XLogP74.12
TPSA327.58 Ų
H-Bond Donors1
H-Bond Acceptors25
Rotatable Bonds33
Heavy Atoms278
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003914.47
LogP ≤ 574.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-1,2-bis(4-chlorophenyl)-N,N'-bis[[1-[2-(4-fluorophenoxy)ethyl]piperidin-4-yl]methyl]-1,2-dipyridin-2-ylethane-1,2-diamine
CID 137423627
(2R)-1,2-bis(4-chlorophenyl)-N,N'-bis[[1-[2-(2,5-difluorophenoxy)ethyl]piperidin-4-yl]methyl]-1,2-dipyridin-2-ylethane-1,2-diamine
CID 137423662
(2S)-1,2-bis(4-chlorophenyl)-N,N'-dimethyl-1,2-dipyridin-2-yl-N,N'-bis[[1-[2-[4-(trifluoromethyl)phenoxy]ethyl]piperidin-4-yl]methyl]ethane-1,2-diamine
CID 137423670
N-[4-chloro-3-(5-ethoxy-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-(4-ethyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;bis(N-[4-chloro-3-(5-methoxy-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide);N-[4-chloro-3-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 157055431
5-chloro-3-methyl-2-propan-2-ylpyridine;2-chloro-5-propan-2-ylpyridine;3-chloro-2-propan-2-yl-5-(trifluoromethyl)pyridine;5-[(3,4-difluorophenyl)methyl]-2-propan-2-ylpyridine;2,4-dimethyl-6-propan-2-ylpyridine;5-ethyl-2-propan-2-ylpyridine;2-methoxy-5-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine;4-methoxy-2-propan-2-ylpyridine;5-methoxy-2-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;6-propan-2-yl-1H-pyridin-2-one;1-(6-propan-2-yl-3-pyridinyl)ethanol;2-propan-2-yl-4-(trifluoromethyl)pyridine;2-propan-2-yl-6-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine
CID 157101750
N-[4-chloro-3-(5-ethoxy-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-(4-ethyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-(5-fluoro-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-[5-(2,2,2-trifluoroethoxy)-2-pyridinyl]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 157568675
N-[3,3-bis(4-fluorophenyl)propyl]-4-(pyridin-2-ylmethyl)piperidine-1-carboxamide;N-[(2,4-dichlorophenyl)methyl]-4-pyridin-2-yloxypiperidine-1-carboxamide;bis(N-[2-(4-methoxyphenyl)ethyl]-4-pyridin-2-yloxypiperidine-1-carboxamide);N-[2-(4-phenylphenyl)ethyl]-4-(pyridin-2-ylmethyl)piperidine-1-carboxamide;N-[2-(4-phenylphenyl)ethyl]-4-pyridin-2-yloxypiperidine-1-carboxamide;4-pyridin-2-yloxy-N-[[3-(trifluoromethoxy)phenyl]methyl]piperidine-1-carboxamide;4-pyridin-2-yloxy-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]piperidine-1-carboxamide
CID 157702089
N-[3,3-bis(4-fluorophenyl)propyl]-4-(pyridin-3-ylmethyl)piperidine-1-carboxamide;N-[(2-chloro-4-fluorophenyl)methyl]-4-(pyridin-3-ylmethyl)piperidine-1-carboxamide;N-[(2,4-dichlorophenyl)methyl]-4-(pyridin-3-ylmethyl)piperidine-1-carboxamide;3-(hydroxymethyl)-N-[2-(4-methoxyphenyl)ethyl]piperidine-1-carboxamide;3-(hydroxymethyl)-N-[[3-(trifluoromethoxy)phenyl]methyl]piperidine-1-carboxamide;3-(hydroxymethyl)-N-[[6-(trifluoromethyl)-3-pyridinyl]methyl]piperidine-1-carboxamide;N-(naphthalen-1-ylmethyl)-4-(pyridin-3-ylmethyl)piperidine-1-carboxamide;N-[2-(4-phenylphenyl)ethyl]-4-pyridin-3-yloxypiperidine-1-carboxamide
CID 157762463
2-Chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine
CID 158470081
bis(N-[4-chloro-3-(5-ethoxy-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide);N-[4-chloro-3-(4-ethyl-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide;N-[4-chloro-3-(5-fluoro-2-pyridinyl)phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 158716188
6-[(5-chloro-3-pyridinyl)oxymethyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;6-[(2-chloro-4-pyridinyl)oxymethyl]-N-[(2R)-3,3-dimethylbutan-2-yl]pyridine-3-carboxamide;6-[(5-chloro-3-pyridinyl)oxymethyl]-N-[(2R)-3,3-dimethylbutan-2-yl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(5-fluoro-3-pyridinyl)oxymethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(2-methyl-4-pyridinyl)oxymethyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[[5-(trifluoromethyl)-3-pyridinyl]oxymethyl]pyridine-3-carboxamide
CID 158799306
6-[(2-chloro-4-pyridinyl)oxymethyl]-N-[(1R)-1-cyclohexylethyl]pyridine-3-carboxamide;6-[(2-chloro-4-pyridinyl)oxymethyl]-N-[(2R)-3,3-dimethylbutan-2-yl]pyridine-3-carboxamide;N-(1-cyclohexylethyl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide;N-[(1R)-1-cyclohexylethyl]-6-[(5-fluoro-3-pyridinyl)oxymethyl]pyridine-3-carboxamide;N-(3,3-difluorobutan-2-yl)-6-[(3-fluorophenoxy)methyl]pyridine-3-carboxamide;6-[(3-fluorophenoxy)methyl]-N-[1-(oxan-2-yl)ethyl]pyridine-3-carboxamide
CID 158886903

Frequently Asked Questions

What is the IUPAC name of bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine?
The IUPAC name of bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine (CID 159678693) is bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine.
What is the SMILES notation for bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine?
The canonical SMILES for bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine is C.C.C.C.C.C.C.C.C.C.C.CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(OCC(F)(F)F)cn1.CC(C)c1ccccc1Cl.CC(C)c1cccnc1.CC(C)c1cccnc1F.CC(C)c1ccncc1.CCc1cc(C(C)C)ccn1.CCc1cncc(C(C)C)c1.CCc1ncccc1C(C)C.COc1ccc(C(C)C)c(F)c1.COc1ccc(C(C)C)cc1.COc1ccc(C(C)C)cn1.Cc1cc(C(C)C)ccn1.Cc1cc(C(C)C)ccn1.Cc1cc(C(C)C)cnc1Cl.Cc1cc(C(C)C)cnc1Cl.Cc1ccc(C(C)C)c(C)n1.Cc1ccc(C(C)C)cn1.Cc1cnc(C)c(C(C)C)c1.Cc1cncc(C(C)C)c1F.Cc1nc(C(C)C)ccc1F.Cc1ncc(F)cc1C(C)C.Cc1ncccc1C(C)C.Cc1ncccc1C(C)C.
What is the InChIKey of bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine?
The InChIKey is MUYAQMMOUAEIHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3NO.C10H13FO.5C10H15N.C10H14O.2C9H12ClN.2C9H11Cl.3C9H12FN.C9H13NO.5C9H13N.C8H10FN.C8H11NO.2C8H11N.11CH4/c1-7(2)9-4-3-8(5-14-9)15-6-10(11,12)13;1-7(2)9-5-4-8(12-3)6-10(9)11;1-7(2)10-5-8(3)6-11-9(10)4;1-7(2)10-6-5-8(3)11-9(10)4;1-4-9-5-10(8(2)3)7-11-6-9;1-4-10-7-9(8(2)3)5-6-11-10;1-4-10-9(8(2)3)6-5-7-11-10;1-8(2)9-4-6-10(11-3)7-5-9;2*1-6(2)8-4-7(3)9(10)11-5-8;1-7(2)8-3-5-9(10)6-4-8;1-7(2)8-5-3-4-6-9(8)10;1-6(2)9-4-8(10)5-11-7(9)3;1-6(2)8-5-11-4-7(3)9(8)10;1-6(2)9-5-4-8(10)7(3)11-9;1-7(2)8-4-5-9(11-3)10-6-8;2*1-7(2)9-4-5-10-8(3)6-9;1-7(2)9-5-4-8(3)10-6-9;2*1-7(2)9-5-4-6-10-8(9)3;1-6(2)7-4-3-5-10-8(7)9;1-6(2)7-3-4-8(10)9-5-7;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;;;;;;;;;;;/h3-5,7H,6H2,1-2H3;4-7H,1-3H3;2*5-7H,1-4H3;3*5-8H,4H2,1-3H3;4-8H,1-3H3;2*4-6H,1-3H3;2*3-7H,1-2H3;3*4-6H,1-3H3;4-7H,1-3H3;5*4-7H,1-3H3;3-6H,1-2H3;3-6H,1-2H3,(H,9,10);2*3-7H,1-2H3;11*1H4.
What are the key properties of bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine?
bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine has a molecular weight of 3914.47 g/mol, XLogP of 74.12, 33 rotatable bonds, 1 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-chloro-3-methyl-5-propan-2-ylpyridine);1-chloro-2-propan-2-ylbenzene;1-chloro-4-propan-2-ylbenzene;2,5-dimethyl-3-propan-2-ylpyridine;2,6-dimethyl-3-propan-2-ylpyridine;2-ethyl-3-propan-2-ylpyridine;2-ethyl-4-propan-2-ylpyridine;3-ethyl-5-propan-2-ylpyridine;2-fluoro-4-methoxy-1-propan-2-ylbenzene;3-fluoro-2-methyl-6-propan-2-ylpyridine;4-fluoro-3-methyl-5-propan-2-ylpyridine;5-fluoro-2-methyl-3-propan-2-ylpyridine;2-fluoro-3-propan-2-ylpyridine;methane;1-methoxy-4-propan-2-ylbenzene;2-methoxy-5-propan-2-ylpyridine;bis(2-methyl-3-propan-2-ylpyridine);bis(2-methyl-4-propan-2-ylpyridine);2-methyl-5-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-yl-1H-pyridin-2-one;2-propan-2-yl-5-(2,2,2-trifluoroethoxy)pyridine is sourced from PubChem (CID 159678693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).