5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine

C143H154Cl4F13N5O — CID 158916795

IUPAC5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine
SMILESCC(C)c1ccc(-c2cccc(Cl)c2)cc1.CC(C)c1ccc(-c2cccc(Cl)c2)cn1.CC(C)c1ccc(-c2cccc(F)c2)cc1.CC(C)c1ccc(-c2cccc(F)c2)cn1.CC(C)c1ccc(-c2ccccc2Cl)cn1.CC(C)c1ccc(-c2ccccc2F)cn1.CC(C)c1ccc(C(F)(F)F)cc1.CC(C)c1ccc(C(F)(F)F)cn1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc(OC(F)(F)F)cc1.Cc1ccc(C(C)C)cc1
InChIInChI=1S/C15H15Cl.C15H15F.2C14H14ClN.2C14H14FN.C10H11F3O.C10H11F3.C10H14.C9H11Cl.C9H10F3N.C9H11F/c2*1-11(2)12-6-8-13(9-7-12)14-4-3-5-15(16)10-14;1-10(2)14-7-6-12(9-16-14)11-4-3-5-13(15)8-11;1-10(2)14-8-7-11(9-16-14)12-5-3-4-6-13(12)15;1-10(2)14-7-6-12(9-16-14)11-4-3-5-13(15)8-11;1-10(2)14-8-7-11(9-16-14)12-5-3-4-6-13(12)15;1-7(2)8-3-5-9(6-4-8)14-10(11,12)13;1-7(2)8-3-5-9(6-4-8)10(11,12)13;1-8(2)10-6-4-9(3)5-7-10;1-7(2)8-3-5-9(10)6-4-8;1-6(2)8-4-3-7(5-13-8)9(10,11)12;1-7(2)8-3-5-9(10)6-4-8/h2*3-11H,1-2H3;4*3-10H,1-2H3;3-7H,1-2H3;3-7H,1-2H3;4-8H,1-3H3;3-7H,1-2H3;3-6H,1-2H3;3-7H,1-2H3
InChIKeyJHIFRTNNOLPHRD-UHFFFAOYSA-N
MW2347.62 g/mol
LogP47.11
Rot. Bonds19

About 5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine

5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine (PubChem CID 158916795) has the molecular formula C143H154Cl4F13N5O and a molecular weight of 2347.62 g/mol. Its IUPAC name is 5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine
PubChem CID158916795
Molecular FormulaC143H154Cl4F13N5O
Molecular Weight2347.62 g/mol
Exact Mass2344.07
IUPAC Name5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine
SMILESCC(C)c1ccc(-c2cccc(Cl)c2)cc1.CC(C)c1ccc(-c2cccc(Cl)c2)cn1.CC(C)c1ccc(-c2cccc(F)c2)cc1.CC(C)c1ccc(-c2cccc(F)c2)cn1.CC(C)c1ccc(-c2ccccc2Cl)cn1.CC(C)c1ccc(-c2ccccc2F)cn1.CC(C)c1ccc(C(F)(F)F)cc1.CC(C)c1ccc(C(F)(F)F)cn1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc(OC(F)(F)F)cc1.Cc1ccc(C(C)C)cc1
InChIInChI=1S/C15H15Cl.C15H15F.2C14H14ClN.2C14H14FN.C10H11F3O.C10H11F3.C10H14.C9H11Cl.C9H10F3N.C9H11F/c2*1-11(2)12-6-8-13(9-7-12)14-4-3-5-15(16)10-14;1-10(2)14-7-6-12(9-16-14)11-4-3-5-13(15)8-11;1-10(2)14-8-7-11(9-16-14)12-5-3-4-6-13(12)15;1-10(2)14-7-6-12(9-16-14)11-4-3-5-13(15)8-11;1-10(2)14-8-7-11(9-16-14)12-5-3-4-6-13(12)15;1-7(2)8-3-5-9(6-4-8)14-10(11,12)13;1-7(2)8-3-5-9(6-4-8)10(11,12)13;1-8(2)10-6-4-9(3)5-7-10;1-7(2)8-3-5-9(10)6-4-8;1-6(2)8-4-3-7(5-13-8)9(10,11)12;1-7(2)8-3-5-9(10)6-4-8/h2*3-11H,1-2H3;4*3-10H,1-2H3;3-7H,1-2H3;3-7H,1-2H3;4-8H,1-3H3;3-7H,1-2H3;3-6H,1-2H3;3-7H,1-2H3
InChIKeyJHIFRTNNOLPHRD-UHFFFAOYSA-N
XLogP47.11
TPSA73.68 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds19
Heavy Atoms166
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002347.62
LogP ≤ 547.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine with MolForge

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Related Compounds

2-[4-[4-[(4-Chloro-3-fluorophenoxy)-difluoromethyl]-3,5-difluorophenyl]-3-fluorophenyl]-5-(4-pentylcyclohexyl)pyridine
CID 58383331
2-[4-[4-[[4-(4-Chloro-3,5-difluorophenyl)-3-fluorophenoxy]-difluoromethyl]-3,5-difluorophenyl]-3-fluorophenyl]-5-pentylpyridine
CID 58383459
2-[4-[4-[[4-(4-Chloro-3-fluorophenyl)-3-fluorophenoxy]-difluoromethyl]-3,5-difluorophenyl]-3-fluorophenyl]-5-pentylpyridine
CID 58383549
2-[4-[[4-[4-(4-Chloro-3,5-difluorophenyl)-3-fluorophenyl]-3-fluorophenoxy]-difluoromethyl]-3,5-difluorophenyl]-5-pentylpyridine
CID 58383675
2-[3-Chloro-2-fluoro-4-(4-pentylcyclohexen-1-yl)phenyl]-5-(4-methoxyphenyl)pyridine
CID 59257133
2-Chloro-5-[4-(4-ethoxyphenyl)-2-(4-pentylphenyl)-3-[6-(trifluoromethyl)-3-pyridinyl]butyl]pyridine
CID 88528373
(2S)-1,2-bis(4-chlorophenyl)-N,N'-bis[[1-[2-(2-fluorophenoxy)ethyl]piperidin-4-yl]methyl]-N,N'-dimethyl-1,2-dipyridin-2-ylethane-1,2-diamine
CID 137423581
(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
CID 137423832
CID 137423832
CID 137423909
CID 137423909
N-[3-chloro-4-[5-[[4-(5-cyano-6-methoxy-4-pyridin-4-yl-2-pyridinyl)phenyl]azaniumylidynemethyl]-4-(4-fluorophenyl)-6-methoxy-2-pyridinyl]phenyl]-6-(3-chlorophenyl)-4-(4-fluorophenyl)-2-methoxypyridine-3-carbonitrilium
CID 154644738
2-(4-Chloro-2-methoxyphenyl)-6-propan-2-ylpyridine;bis(2-(4-chlorophenyl)-3-fluoro-6-propan-2-ylpyridine);2-(2-chlorophenyl)-6-propan-2-ylpyridine;2-[4-chloro-3-(trifluoromethyl)phenyl]-6-propan-2-ylpyridine;2-(3,4-dimethylphenyl)-6-propan-2-ylpyridine;2-(4-methoxyphenyl)-6-propan-2-ylpyridine;2-(4-methylphenyl)-6-propan-2-ylpyridine
CID 157075040

Frequently Asked Questions

What is the IUPAC name of 5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine?
The IUPAC name of 5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine (CID 158916795) is 5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine?
The canonical SMILES for 5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine is CC(C)c1ccc(-c2cccc(Cl)c2)cc1.CC(C)c1ccc(-c2cccc(Cl)c2)cn1.CC(C)c1ccc(-c2cccc(F)c2)cc1.CC(C)c1ccc(-c2cccc(F)c2)cn1.CC(C)c1ccc(-c2ccccc2Cl)cn1.CC(C)c1ccc(-c2ccccc2F)cn1.CC(C)c1ccc(C(F)(F)F)cc1.CC(C)c1ccc(C(F)(F)F)cn1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccc(OC(F)(F)F)cc1.Cc1ccc(C(C)C)cc1.
What is the InChIKey of 5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine?
The InChIKey is JHIFRTNNOLPHRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl.C15H15F.2C14H14ClN.2C14H14FN.C10H11F3O.C10H11F3.C10H14.C9H11Cl.C9H10F3N.C9H11F/c2*1-11(2)12-6-8-13(9-7-12)14-4-3-5-15(16)10-14;1-10(2)14-7-6-12(9-16-14)11-4-3-5-13(15)8-11;1-10(2)14-8-7-11(9-16-14)12-5-3-4-6-13(12)15;1-10(2)14-7-6-12(9-16-14)11-4-3-5-13(15)8-11;1-10(2)14-8-7-11(9-16-14)12-5-3-4-6-13(12)15;1-7(2)8-3-5-9(6-4-8)14-10(11,12)13;1-7(2)8-3-5-9(6-4-8)10(11,12)13;1-8(2)10-6-4-9(3)5-7-10;1-7(2)8-3-5-9(10)6-4-8;1-6(2)8-4-3-7(5-13-8)9(10,11)12;1-7(2)8-3-5-9(10)6-4-8/h2*3-11H,1-2H3;4*3-10H,1-2H3;3-7H,1-2H3;3-7H,1-2H3;4-8H,1-3H3;3-7H,1-2H3;3-6H,1-2H3;3-7H,1-2H3.
What are the key properties of 5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine?
5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine has a molecular weight of 2347.62 g/mol, XLogP of 47.11, 19 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chlorophenyl)-2-propan-2-ylpyridine;5-(3-chlorophenyl)-2-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;1-chloro-3-(4-propan-2-ylphenyl)benzene;5-(2-fluorophenyl)-2-propan-2-ylpyridine;5-(3-fluorophenyl)-2-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;1-fluoro-3-(4-propan-2-ylphenyl)benzene;1-methyl-4-propan-2-ylbenzene;1-propan-2-yl-4-(trifluoromethoxy)benzene;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 158916795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).