1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone

C20H19NO — CID 122368712

IUPAC1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone
SMILESCC(=O)N1CC=C(c2cccc(C)c2)C=C1c1ccccc1
InChIInChI=1S/C20H19NO/c1-15-7-6-10-18(13-15)19-11-12-21(16(2)22)20(14-19)17-8-4-3-5-9-17/h3-11,13-14H,12H2,1-2H3
InChIKeyFSEASHFZUFEETN-UHFFFAOYSA-N
MW289.38 g/mol
LogP4.28
Rot. Bonds2

About 1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone

1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone (PubChem CID 122368712) has the molecular formula C20H19NO and a molecular weight of 289.38 g/mol. Its IUPAC name is 1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone
PubChem CID122368712
Molecular FormulaC20H19NO
Molecular Weight289.38 g/mol
Exact Mass289.15
IUPAC Name1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone
SMILESCC(=O)N1CC=C(c2cccc(C)c2)C=C1c1ccccc1
InChIInChI=1S/C20H19NO/c1-15-7-6-10-18(13-15)19-11-12-21(16(2)22)20(14-19)17-8-4-3-5-9-17/h3-11,13-14H,12H2,1-2H3
InChIKeyFSEASHFZUFEETN-UHFFFAOYSA-N
XLogP4.28
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[4-(3-methylphenyl)-3,6-dihydro-2H-pyridin-1-yl]ethanone
CID 154320676
2-[4-(3-methylphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]cyclobutane-1-carboxylic acid
CID 120977486
acetic acid;azane;1,3-xylene
CID 21426934
1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 58879503
ethane;1-methyl-3-phenylbenzene
CID 142040878
1-benzyl-4-[[3-(3-methylphenyl)cyclopenta-1,3-dien-1-yl]methyl]benzene
CID 59994233
ethane;methane;1-methyl-3-[4-(4-methylphenyl)phenyl]benzene;1-phenylethanone
CID 160788394
ethene;1-methyl-3-phenylbenzene
CID 142622149
1-(3-methylphenyl)-3-phenyl-5-(3-phenylphenyl)benzene
CID 123280286
methanamine;1-methyl-3-phenylbenzene
CID 145414985
1-methyl-3-[3-[3-(4-phenylphenyl)phenyl]phenyl]benzene
CID 153438411
ethane;1-methyl-3-[4-(4-phenylphenyl)phenyl]benzene
CID 142439051

Frequently Asked Questions

What is the IUPAC name of 1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone?
The IUPAC name of 1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone (CID 122368712) is 1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone.
What is the SMILES notation for 1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone?
The canonical SMILES for 1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone is CC(=O)N1CC=C(c2cccc(C)c2)C=C1c1ccccc1.
What is the InChIKey of 1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone?
The InChIKey is FSEASHFZUFEETN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO/c1-15-7-6-10-18(13-15)19-11-12-21(16(2)22)20(14-19)17-8-4-3-5-9-17/h3-11,13-14H,12H2,1-2H3.
What are the key properties of 1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone?
1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone has a molecular weight of 289.38 g/mol, XLogP of 4.28, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(3-methylphenyl)-6-phenyl-2H-pyridin-1-yl]ethanone is sourced from PubChem (CID 122368712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).