(4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone

C17H17NO — CID 106754787

IUPAC(4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone
SMILESCc1cc(C(=O)c2ccc(C3CCC3)cc2)ccn1
InChIInChI=1S/C17H17NO/c1-12-11-16(9-10-18-12)17(19)15-7-5-14(6-8-15)13-3-2-4-13/h5-11,13H,2-4H2,1H3
InChIKeySHYHNSXYZGJKOM-UHFFFAOYSA-N
MW251.33 g/mol
LogP3.89
Rot. Bonds3

About (4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone

(4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone (PubChem CID 106754787) has the molecular formula C17H17NO and a molecular weight of 251.33 g/mol. Its IUPAC name is (4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone.

Molecular Properties

Compound Name(4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone
PubChem CID106754787
Molecular FormulaC17H17NO
Molecular Weight251.33 g/mol
Exact Mass251.13
IUPAC Name(4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone
SMILESCc1cc(C(=O)c2ccc(C3CCC3)cc2)ccn1
InChIInChI=1S/C17H17NO/c1-12-11-16(9-10-18-12)17(19)15-7-5-14(6-8-15)13-3-2-4-13/h5-11,13H,2-4H2,1H3
InChIKeySHYHNSXYZGJKOM-UHFFFAOYSA-N
XLogP3.89
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4-cyclohexylphenyl)-pyridin-4-ylmethanone
CID 43160506
(2-methyl-4-pyridinyl)-phenylmethanone
CID 12913274
[3,5-bis(4-cyclohexylbenzoyl)phenyl]-(4-cyclohexylphenyl)methanone
CID 3766004
(6-chloro-3-pyridinyl)-(4-cyclobutylphenyl)methanone
CID 116505677
(4-bromophenyl)-(4-cyclohexylphenyl)methanone
CID 43338426
(2-methyl-4-pyridinyl)-pyridin-3-ylmethanone
CID 106754556
2-cyclohexyl-1-(2-methyl-4-pyridinyl)ethanone
CID 106754594
N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide
CID 106754373
1-(4-cyclobutylphenyl)-2-ethylsulfanylethanone
CID 116505606
(3-amino-5-bromophenyl)-(4-cyclobutylphenyl)methanone
CID 116597248
1-(4-cyclobutylphenyl)-2-(methylamino)ethanone
CID 116553849
N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpyridine-4-carboxamide
CID 106753486

Frequently Asked Questions

What is the IUPAC name of (4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone?
The IUPAC name of (4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone (CID 106754787) is (4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone.
What is the SMILES notation for (4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone?
The canonical SMILES for (4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone is Cc1cc(C(=O)c2ccc(C3CCC3)cc2)ccn1.
What is the InChIKey of (4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone?
The InChIKey is SHYHNSXYZGJKOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO/c1-12-11-16(9-10-18-12)17(19)15-7-5-14(6-8-15)13-3-2-4-13/h5-11,13H,2-4H2,1H3.
What are the key properties of (4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone?
(4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone has a molecular weight of 251.33 g/mol, XLogP of 3.89, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclobutylphenyl)-(2-methyl-4-pyridinyl)methanone is sourced from PubChem (CID 106754787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).