3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine

C191H255BrCl2F10N20O8 — CID 158347480

IUPAC3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine
SMILESCC(C)c1ccc(=O)[nH]c1.CC(C)c1ccc(=O)n(C)c1.CC(C)c1ccc(=O)n(C)c1.CC(C)c1ccc(=O)n(C2CC2)c1.CC(C)c1ccc(C(F)(F)F)cc1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccccc1.CC(C)c1cnc(C(F)(F)F)cn1.CC(C)c1cnc(C(F)(F)F)nc1.CC(C)c1cncc(Br)c1.CC(C)c1cncc(Cl)c1.Cc1cc(=O)c(C(C)C)c[nH]1.Cc1cc(C)c(C(C)C)cn1.Cc1ccc(C(C)C)c(=O)[nH]1.Cc1ccc(C(C)C)c[n+]1[O-].Cc1ccc(C(C)C)cc1.Cc1cnc(C(C)C)cn1.Cc1ncc(C(C)C)c2ccccc12.Cc1ncc(C(C)C)cc1O.Cc1ncc(C(C)C)cn1
InChIInChI=1S/C13H15N.C11H15NO.C10H11F3.C10H15N.C10H14.C9H11Cl.C9H11F.6C9H13NO.C9H12.C8H10BrN.C8H10ClN.2C8H9F3N2.2C8H12N2.C8H11NO/c1-9(2)13-8-14-10(3)11-6-4-5-7-12(11)13;1-8(2)9-3-6-11(13)12(7-9)10-4-5-10;1-7(2)8-3-5-9(6-4-8)10(11,12)13;1-7(2)10-6-11-9(4)5-8(10)3;1-8(2)10-6-4-9(3)5-7-10;2*1-7(2)8-3-5-9(10)6-4-8;1-6(2)8-4-9(11)7(3)10-5-8;1-6(2)8-5-10-7(3)4-9(8)11;2*1-7(2)8-4-5-9(11)10(3)6-8;1-7(2)9-5-4-8(3)10(11)6-9;1-6(2)8-5-4-7(3)10-9(8)11;1-8(2)9-6-4-3-5-7-9;2*1-6(2)7-3-8(9)5-10-4-7;1-5(2)6-3-13-7(4-12-6)8(9,10)11;1-5(2)6-3-12-7(13-4-6)8(9,10)11;1-6(2)8-4-9-7(3)10-5-8;1-6(2)8-5-9-7(3)4-10-8;1-6(2)7-3-4-8(10)9-5-7/h4-9H,1-3H3;3,6-8,10H,4-5H2,1-2H3;3-7H,1-2H3;5-7H,1-4H3;4-8H,1-3H3;2*3-7H,1-2H3;4-6,11H,1-3H3;4-6H,1-3H3,(H,10,11);3*4-7H,1-3H3;4-6H,1-3H3,(H,10,11);3-8H,1-2H3;2*3-6H,1-2H3;2*3-5H,1-2H3;2*4-6H,1-3H3;3-6H,1-2H3,(H,9,10)
InChIKeyGRXHTOXYCKBNFH-UHFFFAOYSA-N
MW3300.06 g/mol
LogP51.95
Rot. Bonds22

About 3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine

3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine (PubChem CID 158347480) has the molecular formula C191H255BrCl2F10N20O8 and a molecular weight of 3300.06 g/mol. Its IUPAC name is 3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine.

Molecular Properties

Compound Name3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine
PubChem CID158347480
Molecular FormulaC191H255BrCl2F10N20O8
Molecular Weight3300.06 g/mol
Exact Mass3295.86
IUPAC Name3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine
SMILESCC(C)c1ccc(=O)[nH]c1.CC(C)c1ccc(=O)n(C)c1.CC(C)c1ccc(=O)n(C)c1.CC(C)c1ccc(=O)n(C2CC2)c1.CC(C)c1ccc(C(F)(F)F)cc1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccccc1.CC(C)c1cnc(C(F)(F)F)cn1.CC(C)c1cnc(C(F)(F)F)nc1.CC(C)c1cncc(Br)c1.CC(C)c1cncc(Cl)c1.Cc1cc(=O)c(C(C)C)c[nH]1.Cc1cc(C)c(C(C)C)cn1.Cc1ccc(C(C)C)c(=O)[nH]1.Cc1ccc(C(C)C)c[n+]1[O-].Cc1ccc(C(C)C)cc1.Cc1cnc(C(C)C)cn1.Cc1ncc(C(C)C)c2ccccc12.Cc1ncc(C(C)C)cc1O.Cc1ncc(C(C)C)cn1
InChIInChI=1S/C13H15N.C11H15NO.C10H11F3.C10H15N.C10H14.C9H11Cl.C9H11F.6C9H13NO.C9H12.C8H10BrN.C8H10ClN.2C8H9F3N2.2C8H12N2.C8H11NO/c1-9(2)13-8-14-10(3)11-6-4-5-7-12(11)13;1-8(2)9-3-6-11(13)12(7-9)10-4-5-10;1-7(2)8-3-5-9(6-4-8)10(11,12)13;1-7(2)10-6-11-9(4)5-8(10)3;1-8(2)10-6-4-9(3)5-7-10;2*1-7(2)8-3-5-9(10)6-4-8;1-6(2)8-4-9(11)7(3)10-5-8;1-6(2)8-5-10-7(3)4-9(8)11;2*1-7(2)8-4-5-9(11)10(3)6-8;1-7(2)9-5-4-8(3)10(11)6-9;1-6(2)8-5-4-7(3)10-9(8)11;1-8(2)9-6-4-3-5-7-9;2*1-6(2)7-3-8(9)5-10-4-7;1-5(2)6-3-13-7(4-12-6)8(9,10)11;1-5(2)6-3-12-7(13-4-6)8(9,10)11;1-6(2)8-4-9-7(3)10-5-8;1-6(2)8-5-9-7(3)4-10-8;1-6(2)7-3-4-8(10)9-5-7/h4-9H,1-3H3;3,6-8,10H,4-5H2,1-2H3;3-7H,1-2H3;5-7H,1-4H3;4-8H,1-3H3;2*3-7H,1-2H3;4-6,11H,1-3H3;4-6H,1-3H3,(H,10,11);3*4-7H,1-3H3;4-6H,1-3H3,(H,10,11);3-8H,1-2H3;2*3-6H,1-2H3;2*3-5H,1-2H3;2*4-6H,1-3H3;3-6H,1-2H3,(H,9,10)
InChIKeyGRXHTOXYCKBNFH-UHFFFAOYSA-N
XLogP51.95
TPSA379.32 Ų
H-Bond Donors4
H-Bond Acceptors24
Rotatable Bonds22
Heavy Atoms232
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003300.06
LogP ≤ 551.95
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1024

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine?
The IUPAC name of 3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine (CID 158347480) is 3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine.
What is the SMILES notation for 3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine?
The canonical SMILES for 3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine is CC(C)c1ccc(=O)[nH]c1.CC(C)c1ccc(=O)n(C)c1.CC(C)c1ccc(=O)n(C)c1.CC(C)c1ccc(=O)n(C2CC2)c1.CC(C)c1ccc(C(F)(F)F)cc1.CC(C)c1ccc(Cl)cc1.CC(C)c1ccc(F)cc1.CC(C)c1ccccc1.CC(C)c1cnc(C(F)(F)F)cn1.CC(C)c1cnc(C(F)(F)F)nc1.CC(C)c1cncc(Br)c1.CC(C)c1cncc(Cl)c1.Cc1cc(=O)c(C(C)C)c[nH]1.Cc1cc(C)c(C(C)C)cn1.Cc1ccc(C(C)C)c(=O)[nH]1.Cc1ccc(C(C)C)c[n+]1[O-].Cc1ccc(C(C)C)cc1.Cc1cnc(C(C)C)cn1.Cc1ncc(C(C)C)c2ccccc12.Cc1ncc(C(C)C)cc1O.Cc1ncc(C(C)C)cn1.
What is the InChIKey of 3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine?
The InChIKey is GRXHTOXYCKBNFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N.C11H15NO.C10H11F3.C10H15N.C10H14.C9H11Cl.C9H11F.6C9H13NO.C9H12.C8H10BrN.C8H10ClN.2C8H9F3N2.2C8H12N2.C8H11NO/c1-9(2)13-8-14-10(3)11-6-4-5-7-12(11)13;1-8(2)9-3-6-11(13)12(7-9)10-4-5-10;1-7(2)8-3-5-9(6-4-8)10(11,12)13;1-7(2)10-6-11-9(4)5-8(10)3;1-8(2)10-6-4-9(3)5-7-10;2*1-7(2)8-3-5-9(10)6-4-8;1-6(2)8-4-9(11)7(3)10-5-8;1-6(2)8-5-10-7(3)4-9(8)11;2*1-7(2)8-4-5-9(11)10(3)6-8;1-7(2)9-5-4-8(3)10(11)6-9;1-6(2)8-5-4-7(3)10-9(8)11;1-8(2)9-6-4-3-5-7-9;2*1-6(2)7-3-8(9)5-10-4-7;1-5(2)6-3-13-7(4-12-6)8(9,10)11;1-5(2)6-3-12-7(13-4-6)8(9,10)11;1-6(2)8-4-9-7(3)10-5-8;1-6(2)8-5-9-7(3)4-10-8;1-6(2)7-3-4-8(10)9-5-7/h4-9H,1-3H3;3,6-8,10H,4-5H2,1-2H3;3-7H,1-2H3;5-7H,1-4H3;4-8H,1-3H3;2*3-7H,1-2H3;4-6,11H,1-3H3;4-6H,1-3H3,(H,10,11);3*4-7H,1-3H3;4-6H,1-3H3,(H,10,11);3-8H,1-2H3;2*3-6H,1-2H3;2*3-5H,1-2H3;2*4-6H,1-3H3;3-6H,1-2H3,(H,9,10).
What are the key properties of 3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine?
3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine has a molecular weight of 3300.06 g/mol, XLogP of 51.95, 22 rotatable bonds, 4 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-propan-2-ylpyridine;1-chloro-4-propan-2-ylbenzene;3-chloro-5-propan-2-ylpyridine;cumene;1-cyclopropyl-5-propan-2-ylpyridin-2-one;2,4-dimethyl-5-propan-2-ylpyridine;1-fluoro-4-propan-2-ylbenzene;2-methyl-1-oxido-5-propan-2-ylpyridin-1-ium;1-methyl-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylisoquinoline;2-methyl-5-propan-2-ylpyrazine;2-methyl-5-propan-2-ylpyridin-3-ol;bis(1-methyl-5-propan-2-ylpyridin-2-one);2-methyl-5-propan-2-yl-1H-pyridin-4-one;6-methyl-3-propan-2-yl-1H-pyridin-2-one;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-1H-pyridin-2-one;1-propan-2-yl-4-(trifluoromethyl)benzene;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine is sourced from PubChem (CID 158347480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).