N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide

C19H22N2O2 — CID 167899942

IUPACN-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide
SMILESCOc1ccc(CNc2cccc(C(=O)NC3CC3)c2)c(C)c1
InChIInChI=1S/C19H22N2O2/c1-13-10-18(23-2)9-6-15(13)12-20-17-5-3-4-14(11-17)19(22)21-16-7-8-16/h3-6,9-11,16,20H,7-8,12H2,1-2H3,(H,21,22)
InChIKeyAZWHYEGDCCQPET-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.51
Rot. Bonds6

About N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide

N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide (PubChem CID 167899942) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide
PubChem CID167899942
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide
SMILESCOc1ccc(CNc2cccc(C(=O)NC3CC3)c2)c(C)c1
InChIInChI=1S/C19H22N2O2/c1-13-10-18(23-2)9-6-15(13)12-20-17-5-3-4-14(11-17)19(22)21-16-7-8-16/h3-6,9-11,16,20H,7-8,12H2,1-2H3,(H,21,22)
InChIKeyAZWHYEGDCCQPET-UHFFFAOYSA-N
XLogP3.51
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-3-methoxybenzamide
CID 900156
3-[(2-aminophenyl)methylamino]-N-cyclopropylbenzamide
CID 66386042
N-cyclopropyl-3-[(3-methylphenyl)methylamino]benzamide
CID 28658973
N-cyclopropyl-3-[4-(3-methoxybenzoyl)phenyl]-4-methylbenzamide
CID 142750926
3-[(2,4-dimethoxyphenyl)methylamino]benzamide
CID 28650467
methyl 4-[(3-methoxybenzoyl)amino]cyclohexane-1-carboxylate
CID 115617221
4-[[3-[(4-methylphenyl)methylamino]benzoyl]amino]cyclohexane-1-carboxylic acid
CID 162638258
N-cyclopropyl-3-[(1-methylpyrrol-3-yl)methylamino]benzamide
CID 66399986
N-(4-cyanocyclohexyl)-3-methoxybenzamide
CID 115270167
N-cyclopropyl-3-[(3-methoxyphenyl)sulfamoyl]benzamide
CID 109062340
N-cyclopropyl-3-(cyclopropylamino)benzamide
CID 103438850
N-cyclohexyl-3-(methoxyamino)benzamide
CID 142229646

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide?
The IUPAC name of N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide (CID 167899942) is N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide.
What is the SMILES notation for N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide?
The canonical SMILES for N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide is COc1ccc(CNc2cccc(C(=O)NC3CC3)c2)c(C)c1.
What is the InChIKey of N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide?
The InChIKey is AZWHYEGDCCQPET-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-13-10-18(23-2)9-6-15(13)12-20-17-5-3-4-14(11-17)19(22)21-16-7-8-16/h3-6,9-11,16,20H,7-8,12H2,1-2H3,(H,21,22).
What are the key properties of N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide?
N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide has a molecular weight of 310.40 g/mol, XLogP of 3.51, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[(4-methoxy-2-methylphenyl)methylamino]benzamide is sourced from PubChem (CID 167899942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).