[2,5-bis(methylamino)phenyl]-phenylmethanone

C15H16N2O — CID 57239314

IUPAC[2,5-bis(methylamino)phenyl]-phenylmethanone
SMILESCNc1ccc(NC)c(C(=O)c2ccccc2)c1
InChIInChI=1S/C15H16N2O/c1-16-12-8-9-14(17-2)13(10-12)15(18)11-6-4-3-5-7-11/h3-10,16-17H,1-2H3
InChIKeyGGCJZFCDIHELNV-UHFFFAOYSA-N
MW240.31 g/mol
LogP3.00
Rot. Bonds4

About [2,5-bis(methylamino)phenyl]-phenylmethanone

[2,5-bis(methylamino)phenyl]-phenylmethanone (PubChem CID 57239314) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is [2,5-bis(methylamino)phenyl]-phenylmethanone.

Molecular Properties

Compound Name[2,5-bis(methylamino)phenyl]-phenylmethanone
PubChem CID57239314
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name[2,5-bis(methylamino)phenyl]-phenylmethanone
SMILESCNc1ccc(NC)c(C(=O)c2ccccc2)c1
InChIInChI=1S/C15H16N2O/c1-16-12-8-9-14(17-2)13(10-12)15(18)11-6-4-3-5-7-11/h3-10,16-17H,1-2H3
InChIKeyGGCJZFCDIHELNV-UHFFFAOYSA-N
XLogP3.00
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anthranil_one_A(38)', 'substructure': 'N/A'}

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Related Compounds

[2-chloro-5-(methylamino)phenyl]-phenylmethanone
CID 21314189
diphenylmethanone;phenyl-[2,4,6-tris(methylamino)phenyl]methanone
CID 159479843
[3-(methylamino)phenyl]-phenylmethanone
CID 19894083
[4-(methylamino)-3-sulfanylphenyl]-phenylmethanone
CID 101407119
N-[3-benzoyl-4-[[2-(4-methylphenyl)acetyl]amino]phenyl]benzamide
CID 10297535
[5-chloro-2-(methoxyamino)phenyl]-phenylmethanone
CID 145356956
3-(methylamino)benzoic acid;hydrochloride
CID 55250935
N-(4-benzoyl-3-hydroxyphenyl)acetamide
CID 611295
1-(2-benzoyl-4-chlorophenyl)-3-(4-methylphenyl)thiourea
CID 100639453
(5-benzoyl-2,6-dimethyl-3-pyridinyl)-phenylmethanone
CID 827958
N-[2-benzoyl-4-[[2-(3-methylphenyl)acetyl]amino]phenyl]-2-(4-methylphenyl)acetamide
CID 11236897
N-(2-benzoyl-4-fluorophenyl)formamide
CID 168651173

Frequently Asked Questions

What is the IUPAC name of [2,5-bis(methylamino)phenyl]-phenylmethanone?
The IUPAC name of [2,5-bis(methylamino)phenyl]-phenylmethanone (CID 57239314) is [2,5-bis(methylamino)phenyl]-phenylmethanone.
What is the SMILES notation for [2,5-bis(methylamino)phenyl]-phenylmethanone?
The canonical SMILES for [2,5-bis(methylamino)phenyl]-phenylmethanone is CNc1ccc(NC)c(C(=O)c2ccccc2)c1.
What is the InChIKey of [2,5-bis(methylamino)phenyl]-phenylmethanone?
The InChIKey is GGCJZFCDIHELNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-16-12-8-9-14(17-2)13(10-12)15(18)11-6-4-3-5-7-11/h3-10,16-17H,1-2H3.
What are the key properties of [2,5-bis(methylamino)phenyl]-phenylmethanone?
[2,5-bis(methylamino)phenyl]-phenylmethanone has a molecular weight of 240.31 g/mol, XLogP of 3.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2,5-bis(methylamino)phenyl]-phenylmethanone is sourced from PubChem (CID 57239314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).