4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one

C225H326BrClF8N24O4 — CID 165089108

IUPAC4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one
SMILESCC(C)C(Br)c1ccncc1.CC(C)C(C)c1ccncc1.CC(C)C(Cl)c1ccncc1.CC(C)C(F)c1ccncc1.CC(C)CC(=O)Cc1ccncc1.CC(C)CC(=O)N(C)c1ccncc1.CC(C)CCCCc1ccncc1.CC(C)CCCc1cccnc1.CC(C)CCCc1ccncc1.CC(C)CCOc1ccncc1.CC(C)CCc1ccncc1.CC(C)Cc1c(F)cncc1F.CC(C)Cc1cc(F)nc(F)c1.CC(C)Cc1cccnc1.CC(C)Cc1ccncc1.CC(C)Cc1ccncc1C(F)(F)F.CC(C)Cc1ccncc1N1CCCCC1.COc1cnccc1CC(C)C.Cc1cc(CC(C)C)cc(C)n1.Cc1cc(CC(C)C)ccn1.Cc1cncc(C)c1CC(C)C.Cc1cnccc1CC(C)C
InChIInChI=1S/C14H22N2.C12H19N.C11H16N2O.C11H15NO.4C11H17N.C10H12F3N.2C10H15NO.4C10H15N.C9H12BrN.C9H12ClN.2C9H11F2N.C9H12FN.2C9H13N/c1-12(2)10-13-6-7-15-11-14(13)16-8-4-3-5-9-16;1-11(2)5-3-4-6-12-7-9-13-10-8-12;1-9(2)8-11(14)13(3)10-4-6-12-7-5-10;1-9(2)7-11(13)8-10-3-5-12-6-4-10;1-8(2)5-11-9(3)6-12-7-10(11)4;1-8(2)5-11-6-9(3)12-10(4)7-11;1-10(2)5-3-6-11-7-4-8-12-9-11;1-10(2)4-3-5-11-6-8-12-9-7-11;1-7(2)5-8-3-4-14-6-9(8)10(11,12)13;1-9(2)5-8-12-10-3-6-11-7-4-10;1-8(2)6-9-4-5-11-7-10(9)12-3;1-8(2)9(3)10-4-6-11-7-5-10;1-8(2)6-10-4-5-11-7-9(10)3;1-8(2)6-10-4-5-11-9(3)7-10;1-9(2)3-4-10-5-7-11-8-6-10;2*1-7(2)9(10)8-3-5-11-6-4-8;1-6(2)3-7-8(10)4-12-5-9(7)11;1-6(2)3-7-4-8(10)12-9(11)5-7;1-7(2)9(10)8-3-5-11-6-4-8;1-8(2)7-9-3-5-10-6-4-9;1-8(2)6-9-4-3-5-10-7-9/h6-7,11-12H,3-5,8-10H2,1-2H3;7-11H,3-6H2,1-2H3;4-7,9H,8H2,1-3H3;3-6,9H,7-8H2,1-2H3;2*6-8H,5H2,1-4H3;4,7-10H,3,5-6H2,1-2H3;6-10H,3-5H2,1-2H3;3-4,6-7H,5H2,1-2H3;3-4,6-7,9H,5,8H2,1-2H3;4-5,7-8H,6H2,1-3H3;4-9H,1-3H3;2*4-5,7-8H,6H2,1-3H3;5-9H,3-4H2,1-2H3;2*3-7,9H,1-2H3;2*4-6H,3H2,1-2H3;3-7,9H,1-2H3;3-6,8H,7H2,1-2H3;3-5,7-8H,6H2,1-2H3
InChIKeyWKAPXYTWSIFEMK-UHFFFAOYSA-N
MW3698.59 g/mol
LogP60.36
Rot. Bonds59

About 4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one

4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one (PubChem CID 165089108) has the molecular formula C225H326BrClF8N24O4 and a molecular weight of 3698.59 g/mol. Its IUPAC name is 4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one.

Molecular Properties

Compound Name4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one
PubChem CID165089108
Molecular FormulaC225H326BrClF8N24O4
Molecular Weight3698.59 g/mol
Exact Mass3694.48
IUPAC Name4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one
SMILESCC(C)C(Br)c1ccncc1.CC(C)C(C)c1ccncc1.CC(C)C(Cl)c1ccncc1.CC(C)C(F)c1ccncc1.CC(C)CC(=O)Cc1ccncc1.CC(C)CC(=O)N(C)c1ccncc1.CC(C)CCCCc1ccncc1.CC(C)CCCc1cccnc1.CC(C)CCCc1ccncc1.CC(C)CCOc1ccncc1.CC(C)CCc1ccncc1.CC(C)Cc1c(F)cncc1F.CC(C)Cc1cc(F)nc(F)c1.CC(C)Cc1cccnc1.CC(C)Cc1ccncc1.CC(C)Cc1ccncc1C(F)(F)F.CC(C)Cc1ccncc1N1CCCCC1.COc1cnccc1CC(C)C.Cc1cc(CC(C)C)cc(C)n1.Cc1cc(CC(C)C)ccn1.Cc1cncc(C)c1CC(C)C.Cc1cnccc1CC(C)C
InChIInChI=1S/C14H22N2.C12H19N.C11H16N2O.C11H15NO.4C11H17N.C10H12F3N.2C10H15NO.4C10H15N.C9H12BrN.C9H12ClN.2C9H11F2N.C9H12FN.2C9H13N/c1-12(2)10-13-6-7-15-11-14(13)16-8-4-3-5-9-16;1-11(2)5-3-4-6-12-7-9-13-10-8-12;1-9(2)8-11(14)13(3)10-4-6-12-7-5-10;1-9(2)7-11(13)8-10-3-5-12-6-4-10;1-8(2)5-11-9(3)6-12-7-10(11)4;1-8(2)5-11-6-9(3)12-10(4)7-11;1-10(2)5-3-6-11-7-4-8-12-9-11;1-10(2)4-3-5-11-6-8-12-9-7-11;1-7(2)5-8-3-4-14-6-9(8)10(11,12)13;1-9(2)5-8-12-10-3-6-11-7-4-10;1-8(2)6-9-4-5-11-7-10(9)12-3;1-8(2)9(3)10-4-6-11-7-5-10;1-8(2)6-10-4-5-11-7-9(10)3;1-8(2)6-10-4-5-11-9(3)7-10;1-9(2)3-4-10-5-7-11-8-6-10;2*1-7(2)9(10)8-3-5-11-6-4-8;1-6(2)3-7-8(10)4-12-5-9(7)11;1-6(2)3-7-4-8(10)12-9(11)5-7;1-7(2)9(10)8-3-5-11-6-4-8;1-8(2)7-9-3-5-10-6-4-9;1-8(2)6-9-4-3-5-10-7-9/h6-7,11-12H,3-5,8-10H2,1-2H3;7-11H,3-6H2,1-2H3;4-7,9H,8H2,1-3H3;3-6,9H,7-8H2,1-2H3;2*6-8H,5H2,1-4H3;4,7-10H,3,5-6H2,1-2H3;6-10H,3-5H2,1-2H3;3-4,6-7H,5H2,1-2H3;3-4,6-7,9H,5,8H2,1-2H3;4-5,7-8H,6H2,1-3H3;4-9H,1-3H3;2*4-5,7-8H,6H2,1-3H3;5-9H,3-4H2,1-2H3;2*3-7,9H,1-2H3;2*4-6H,3H2,1-2H3;3-7,9H,1-2H3;3-6,8H,7H2,1-2H3;3-5,7-8H,6H2,1-2H3
InChIKeyWKAPXYTWSIFEMK-UHFFFAOYSA-N
XLogP60.36
TPSA342.66 Ų
H-Bond Donors
H-Bond Acceptors27
Rotatable Bonds59
Heavy Atoms263
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003698.59
LogP ≤ 560.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

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

Analyze 4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one?
The IUPAC name of 4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one (CID 165089108) is 4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one.
What is the SMILES notation for 4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one?
The canonical SMILES for 4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one is CC(C)C(Br)c1ccncc1.CC(C)C(C)c1ccncc1.CC(C)C(Cl)c1ccncc1.CC(C)C(F)c1ccncc1.CC(C)CC(=O)Cc1ccncc1.CC(C)CC(=O)N(C)c1ccncc1.CC(C)CCCCc1ccncc1.CC(C)CCCc1cccnc1.CC(C)CCCc1ccncc1.CC(C)CCOc1ccncc1.CC(C)CCc1ccncc1.CC(C)Cc1c(F)cncc1F.CC(C)Cc1cc(F)nc(F)c1.CC(C)Cc1cccnc1.CC(C)Cc1ccncc1.CC(C)Cc1ccncc1C(F)(F)F.CC(C)Cc1ccncc1N1CCCCC1.COc1cnccc1CC(C)C.Cc1cc(CC(C)C)cc(C)n1.Cc1cc(CC(C)C)ccn1.Cc1cncc(C)c1CC(C)C.Cc1cnccc1CC(C)C.
What is the InChIKey of 4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one?
The InChIKey is WKAPXYTWSIFEMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2.C12H19N.C11H16N2O.C11H15NO.4C11H17N.C10H12F3N.2C10H15NO.4C10H15N.C9H12BrN.C9H12ClN.2C9H11F2N.C9H12FN.2C9H13N/c1-12(2)10-13-6-7-15-11-14(13)16-8-4-3-5-9-16;1-11(2)5-3-4-6-12-7-9-13-10-8-12;1-9(2)8-11(14)13(3)10-4-6-12-7-5-10;1-9(2)7-11(13)8-10-3-5-12-6-4-10;1-8(2)5-11-9(3)6-12-7-10(11)4;1-8(2)5-11-6-9(3)12-10(4)7-11;1-10(2)5-3-6-11-7-4-8-12-9-11;1-10(2)4-3-5-11-6-8-12-9-7-11;1-7(2)5-8-3-4-14-6-9(8)10(11,12)13;1-9(2)5-8-12-10-3-6-11-7-4-10;1-8(2)6-9-4-5-11-7-10(9)12-3;1-8(2)9(3)10-4-6-11-7-5-10;1-8(2)6-10-4-5-11-7-9(10)3;1-8(2)6-10-4-5-11-9(3)7-10;1-9(2)3-4-10-5-7-11-8-6-10;2*1-7(2)9(10)8-3-5-11-6-4-8;1-6(2)3-7-8(10)4-12-5-9(7)11;1-6(2)3-7-4-8(10)12-9(11)5-7;1-7(2)9(10)8-3-5-11-6-4-8;1-8(2)7-9-3-5-10-6-4-9;1-8(2)6-9-4-3-5-10-7-9/h6-7,11-12H,3-5,8-10H2,1-2H3;7-11H,3-6H2,1-2H3;4-7,9H,8H2,1-3H3;3-6,9H,7-8H2,1-2H3;2*6-8H,5H2,1-4H3;4,7-10H,3,5-6H2,1-2H3;6-10H,3-5H2,1-2H3;3-4,6-7H,5H2,1-2H3;3-4,6-7,9H,5,8H2,1-2H3;4-5,7-8H,6H2,1-3H3;4-9H,1-3H3;2*4-5,7-8H,6H2,1-3H3;5-9H,3-4H2,1-2H3;2*3-7,9H,1-2H3;2*4-6H,3H2,1-2H3;3-7,9H,1-2H3;3-6,8H,7H2,1-2H3;3-5,7-8H,6H2,1-2H3.
What are the key properties of 4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one?
4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one has a molecular weight of 3698.59 g/mol, XLogP of 60.36, 59 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-bromo-2-methylpropyl)pyridine;4-(1-chloro-2-methylpropyl)pyridine;2,6-difluoro-4-(2-methylpropyl)pyridine;3,5-difluoro-4-(2-methylpropyl)pyridine;2,6-dimethyl-4-(2-methylpropyl)pyridine;3,5-dimethyl-4-(2-methylpropyl)pyridine;N,3-dimethyl-N-pyridin-4-ylbutanamide;4-(1-fluoro-2-methylpropyl)pyridine;3-methoxy-4-(2-methylpropyl)pyridine;4-(3-methylbutan-2-yl)pyridine;4-(3-methylbutoxy)pyridine;4-(3-methylbutyl)pyridine;4-(5-methylhexyl)pyridine;2-methyl-4-(2-methylpropyl)pyridine;3-methyl-4-(2-methylpropyl)pyridine;3-(4-methylpentyl)pyridine;4-(4-methylpentyl)pyridine;4-(2-methylpropyl)-3-piperidin-1-ylpyridine;3-(2-methylpropyl)pyridine;4-(2-methylpropyl)pyridine;4-(2-methylpropyl)-3-(trifluoromethyl)pyridine;4-methyl-1-pyridin-4-ylpentan-2-one is sourced from PubChem (CID 165089108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).