(3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one

C27H23NO — CID 102457545

IUPAC(3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one
SMILESCc1ccc(-c2ccccn2)c([C@H](CC(=O)c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C27H23NO/c1-20-15-16-23(26-14-8-9-17-28-26)25(18-20)24(21-10-4-2-5-11-21)19-27(29)22-12-6-3-7-13-22/h2-18,24H,19H2,1H3/t24-/m1/s1
InChIKeySWMTYXQGJAYRLY-XMMPIXPASA-N
MW377.49 g/mol
LogP6.46
Rot. Bonds6

About (3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one

(3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one (PubChem CID 102457545) has the molecular formula C27H23NO and a molecular weight of 377.49 g/mol. Its IUPAC name is (3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one.

Molecular Properties

Compound Name(3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one
PubChem CID102457545
Molecular FormulaC27H23NO
Molecular Weight377.49 g/mol
Exact Mass377.18
IUPAC Name(3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one
SMILESCc1ccc(-c2ccccn2)c([C@H](CC(=O)c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C27H23NO/c1-20-15-16-23(26-14-8-9-17-28-26)25(18-20)24(21-10-4-2-5-11-21)19-27(29)22-12-6-3-7-13-22/h2-18,24H,19H2,1H3/t24-/m1/s1
InChIKeySWMTYXQGJAYRLY-XMMPIXPASA-N
XLogP6.46
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.49
LogP ≤ 56.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-one
CID 67015695
3-[(5-methyl-2-pyridinyl)amino]-1,3-diphenylpropan-1-one
CID 14936528
(5-methyl-2-pyridin-2-ylphenyl)methanol
CID 132605733
1-(3-methylphenyl)-2-(2-pyridin-2-ylphenyl)ethanone
CID 153405908
2-(4-methyl-2-phenylphenyl)pyridine
CID 20606677
2-(2,4-dimethylphenyl)pyridine;ethane
CID 143636710
5-methyl-N-phenyl-2-pyridin-2-ylbenzamide
CID 102459618
1-phenyl-2-(2-pyridin-2-ylphenyl)ethanone
CID 138970108
2-(4-methyl-2-phenylsulfanylphenyl)pyridine
CID 122394964
[2-(4-methylphenyl)-2-oxoethyl] 3,3-diphenylpropanoate
CID 23821920
3-(4-methylphenyl)-1-phenylpentane-1,4-dione
CID 53348977
4,4,4-trifluoro-1-(4-methylphenyl)-3-(3-methyl-2-pyridin-2-ylphenyl)butan-1-one
CID 132578946

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one?
The IUPAC name of (3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one (CID 102457545) is (3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one.
What is the SMILES notation for (3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one?
The canonical SMILES for (3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one is Cc1ccc(-c2ccccn2)c([C@H](CC(=O)c2ccccc2)c2ccccc2)c1.
What is the InChIKey of (3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one?
The InChIKey is SWMTYXQGJAYRLY-XMMPIXPASA-N. The full InChI is InChI=1S/C27H23NO/c1-20-15-16-23(26-14-8-9-17-28-26)25(18-20)24(21-10-4-2-5-11-21)19-27(29)22-12-6-3-7-13-22/h2-18,24H,19H2,1H3/t24-/m1/s1.
What are the key properties of (3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one?
(3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one has a molecular weight of 377.49 g/mol, XLogP of 6.46, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(5-methyl-2-pyridin-2-ylphenyl)-1,3-diphenylpropan-1-one is sourced from PubChem (CID 102457545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).