N-[4-[(N-methylanilino)methyl]phenyl]benzamide

C21H20N2O — CID 170063802

IUPACN-[4-[(N-methylanilino)methyl]phenyl]benzamide
SMILESCN(Cc1ccc(NC(=O)c2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C21H20N2O/c1-23(20-10-6-3-7-11-20)16-17-12-14-19(15-13-17)22-21(24)18-8-4-2-5-9-18/h2-15H,16H2,1H3,(H,22,24)
InChIKeyRQNRVKMIABUZGF-UHFFFAOYSA-N
MW316.40 g/mol
LogP4.58
Rot. Bonds5

About N-[4-[(N-methylanilino)methyl]phenyl]benzamide

N-[4-[(N-methylanilino)methyl]phenyl]benzamide (PubChem CID 170063802) has the molecular formula C21H20N2O and a molecular weight of 316.40 g/mol. Its IUPAC name is N-[4-[(N-methylanilino)methyl]phenyl]benzamide.

Molecular Properties

Compound NameN-[4-[(N-methylanilino)methyl]phenyl]benzamide
PubChem CID170063802
Molecular FormulaC21H20N2O
Molecular Weight316.40 g/mol
Exact Mass316.16
IUPAC NameN-[4-[(N-methylanilino)methyl]phenyl]benzamide
SMILESCN(Cc1ccc(NC(=O)c2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C21H20N2O/c1-23(20-10-6-3-7-11-20)16-17-12-14-19(15-13-17)22-21(24)18-8-4-2-5-9-18/h2-15H,16H2,1H3,(H,22,24)
InChIKeyRQNRVKMIABUZGF-UHFFFAOYSA-N
XLogP4.58
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-ethylphenyl)benzamide
CID 774063
N-[4-[benzyl(methyl)amino]phenyl]-3,4-dimethoxybenzamide
CID 112982300
4-benzamido-N-[(4-ethylphenyl)methyl]-N-methylbenzamide
CID 46536995
N-[4-[benzyl(methyl)amino]phenyl]-1,3-benzodioxole-5-carboxamide
CID 112982312
(Z,2E)-2-ethylidene-N-[4-[(N-methylanilino)methyl]phenyl]pent-3-enamide
CID 170063798
3-amino-N-[4-[(N-methylanilino)methyl]phenyl]-2H-1,4-benzothiazine-6-carboxamide
CID 170068008
N-[4-(sulfanylmethyl)phenyl]benzamide
CID 130322927
3-[4-[benzyl(methyl)amino]phenyl]-1,1-diethylurea
CID 60543423
4-N-benzyl-1-N-[4-(dimethylamino)phenyl]-4-N-methylbenzene-1,4-dicarboxamide
CID 109047140
4-[(N-methylsulfonylanilino)methyl]-N-(4-phenylphenyl)benzamide
CID 1363161
N-[4-[(N-methylanilino)methyl]phenyl]formamide
CID 166899743
N-(2-anilino-2-oxoethyl)-3-[benzyl(methyl)amino]benzamide
CID 110353754

Frequently Asked Questions

What is the IUPAC name of N-[4-[(N-methylanilino)methyl]phenyl]benzamide?
The IUPAC name of N-[4-[(N-methylanilino)methyl]phenyl]benzamide (CID 170063802) is N-[4-[(N-methylanilino)methyl]phenyl]benzamide.
What is the SMILES notation for N-[4-[(N-methylanilino)methyl]phenyl]benzamide?
The canonical SMILES for N-[4-[(N-methylanilino)methyl]phenyl]benzamide is CN(Cc1ccc(NC(=O)c2ccccc2)cc1)c1ccccc1.
What is the InChIKey of N-[4-[(N-methylanilino)methyl]phenyl]benzamide?
The InChIKey is RQNRVKMIABUZGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O/c1-23(20-10-6-3-7-11-20)16-17-12-14-19(15-13-17)22-21(24)18-8-4-2-5-9-18/h2-15H,16H2,1H3,(H,22,24).
What are the key properties of N-[4-[(N-methylanilino)methyl]phenyl]benzamide?
N-[4-[(N-methylanilino)methyl]phenyl]benzamide has a molecular weight of 316.40 g/mol, XLogP of 4.58, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(N-methylanilino)methyl]phenyl]benzamide is sourced from PubChem (CID 170063802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).