N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide

C16H16N2O — CID 23275030

IUPACN-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide
SMILESC/C=N\N(C(=O)c1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C16H16N2O/c1-3-17-18(15-7-5-4-6-8-15)16(19)14-11-9-13(2)10-12-14/h3-12H,1-2H3/b17-3-
InChIKeyWXFPSYMBUDMSLW-YPEHOIGNSA-N
MW252.32 g/mol
LogP3.65
Rot. Bonds3

About N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide

N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide (PubChem CID 23275030) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide.

Molecular Properties

Compound NameN-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide
PubChem CID23275030
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC NameN-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide
SMILESC/C=N\N(C(=O)c1ccc(C)cc1)c1ccccc1
InChIInChI=1S/C16H16N2O/c1-3-17-18(15-7-5-4-6-8-15)16(19)14-11-9-13(2)10-12-14/h3-12H,1-2H3/b17-3-
InChIKeyWXFPSYMBUDMSLW-YPEHOIGNSA-N
XLogP3.65
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-benzoyl-4-methylbenzohydrazide
CID 174274321
N-[1-(N-benzoyl-4-methylanilino)ethenyl]-N-(4-methylphenyl)benzamide
CID 13213795
N-[(Z)-3,3-bis(4-methylphenyl)prop-2-enylideneamino]-N-phenylaniline
CID 91118877
4-chloro-N-nitroso-N-phenylbenzamide
CID 134880089
diphenylmethanone;(4-methylphenyl)-phenylmethanone
CID 69336781
benzoic acid;4-methylbenzoic acid
CID 71272637
N-[(1S)-1-cyclopropylethyl]-4-methyl-N-phenylbenzamide
CID 6923903
acetaldehyde;4-methylbenzoic acid
CID 88694515
N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide
CID 174311463
N-acetyl-4-methyl-N-(4-methylphenyl)benzamide
CID 163721412
1-N,4-N-bis(4-methylphenyl)-1-N,4-N-bis(2-oxo-1,2-diphenylethyl)benzene-1,4-dicarboxamide
CID 43833720
4-acetyl-N-methyl-N-phenylbenzamide;ethane;propane;toluene
CID 143365763

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide?
The IUPAC name of N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide (CID 23275030) is N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide.
What is the SMILES notation for N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide?
The canonical SMILES for N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide is C/C=N\N(C(=O)c1ccc(C)cc1)c1ccccc1.
What is the InChIKey of N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide?
The InChIKey is WXFPSYMBUDMSLW-YPEHOIGNSA-N. The full InChI is InChI=1S/C16H16N2O/c1-3-17-18(15-7-5-4-6-8-15)16(19)14-11-9-13(2)10-12-14/h3-12H,1-2H3/b17-3-.
What are the key properties of N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide?
N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide has a molecular weight of 252.32 g/mol, XLogP of 3.65, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-ethylideneamino]-4-methyl-N-phenylbenzamide is sourced from PubChem (CID 23275030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).