[3-(methylamino)phenyl]-phenylmethanone

C14H13NO — CID 19894083

IUPAC[3-(methylamino)phenyl]-phenylmethanone
SMILESCNc1cccc(C(=O)c2ccccc2)c1
InChIInChI=1S/C14H13NO/c1-15-13-9-5-8-12(10-13)14(16)11-6-3-2-4-7-11/h2-10,15H,1H3
InChIKeyHKQPEXHBDZMKSW-UHFFFAOYSA-N
MW211.26 g/mol
LogP2.96
Rot. Bonds3

About [3-(methylamino)phenyl]-phenylmethanone

[3-(methylamino)phenyl]-phenylmethanone (PubChem CID 19894083) has the molecular formula C14H13NO and a molecular weight of 211.26 g/mol. Its IUPAC name is [3-(methylamino)phenyl]-phenylmethanone.

Molecular Properties

Compound Name[3-(methylamino)phenyl]-phenylmethanone
PubChem CID19894083
Molecular FormulaC14H13NO
Molecular Weight211.26 g/mol
Exact Mass211.10
IUPAC Name[3-(methylamino)phenyl]-phenylmethanone
SMILESCNc1cccc(C(=O)c2ccccc2)c1
InChIInChI=1S/C14H13NO/c1-15-13-9-5-8-12(10-13)14(16)11-6-3-2-4-7-11/h2-10,15H,1H3
InChIKeyHKQPEXHBDZMKSW-UHFFFAOYSA-N
XLogP2.96
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(methylamino)benzoic acid;hydrochloride
CID 55250935
(3,4-dimethylphenyl)-[3-(methylamino)phenyl]methanone
CID 116917283
3-(methylamino)benzamide
CID 18727714
[3-(methylamino)phenyl]-pyridin-3-ylmethanone
CID 116917352
(3-benzoylphenyl)-phenylmethanone;ethane
CID 145125865
ethane;3-(methylamino)benzamide
CID 142071023
diphenylmethanone;phenyl-[2,4,6-tris(methylamino)phenyl]methanone
CID 159479843
[2-chloro-5-(methylamino)phenyl]-phenylmethanone
CID 21314189
[2,5-bis(methylamino)phenyl]-phenylmethanone
CID 57239314
2-(3-benzoylanilino)propanoic acid;hydrate
CID 23341865
1,3-benzodioxol-5-yl-[3-(methylamino)phenyl]methanone
CID 116917301
2-(3-benzoylanilino)ethene-1,1,2-tricarbonitrile
CID 168606423

Frequently Asked Questions

What is the IUPAC name of [3-(methylamino)phenyl]-phenylmethanone?
The IUPAC name of [3-(methylamino)phenyl]-phenylmethanone (CID 19894083) is [3-(methylamino)phenyl]-phenylmethanone.
What is the SMILES notation for [3-(methylamino)phenyl]-phenylmethanone?
The canonical SMILES for [3-(methylamino)phenyl]-phenylmethanone is CNc1cccc(C(=O)c2ccccc2)c1.
What is the InChIKey of [3-(methylamino)phenyl]-phenylmethanone?
The InChIKey is HKQPEXHBDZMKSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO/c1-15-13-9-5-8-12(10-13)14(16)11-6-3-2-4-7-11/h2-10,15H,1H3.
What are the key properties of [3-(methylamino)phenyl]-phenylmethanone?
[3-(methylamino)phenyl]-phenylmethanone has a molecular weight of 211.26 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(methylamino)phenyl]-phenylmethanone is sourced from PubChem (CID 19894083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).