N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide

C19H22ClNO3 — CID 9437289

IUPACN-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide
SMILESCOc1cc(C(=O)NCc2ccccc2Cl)ccc1OCC(C)C
InChIInChI=1S/C19H22ClNO3/c1-13(2)12-24-17-9-8-14(10-18(17)23-3)19(22)21-11-15-6-4-5-7-16(15)20/h4-10,13H,11-12H2,1-3H3,(H,21,22)
InChIKeySZQWOQPRHQREEQ-UHFFFAOYSA-N
MW347.84 g/mol
LogP4.31
Rot. Bonds7

About N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide

N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide (PubChem CID 9437289) has the molecular formula C19H22ClNO3 and a molecular weight of 347.84 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide
PubChem CID9437289
Molecular FormulaC19H22ClNO3
Molecular Weight347.84 g/mol
Exact Mass347.13
IUPAC NameN-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide
SMILESCOc1cc(C(=O)NCc2ccccc2Cl)ccc1OCC(C)C
InChIInChI=1S/C19H22ClNO3/c1-13(2)12-24-17-9-8-14(10-18(17)23-3)19(22)21-11-15-6-4-5-7-16(15)20/h4-10,13H,11-12H2,1-3H3,(H,21,22)
InChIKeySZQWOQPRHQREEQ-UHFFFAOYSA-N
XLogP4.31
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.84
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2-chlorophenyl)methyl]-3-methoxy-N-methyl-4-(2-methylpropoxy)benzamide
CID 112790343
4-[(2-chlorophenyl)methoxy]-N-[[2-[(dimethylamino)methyl]phenyl]methyl]-3-methoxybenzamide
CID 55395887
N-[(2-chlorophenyl)methyl]-4-methoxy-3-sulfamoylbenzamide
CID 36861804
3-chloro-4-methoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 95970560
N-[(2-chlorophenyl)methyl]-2-(3,4-dimethoxyanilino)pyridine-4-carboxamide
CID 109170766
1-N-[(2-chlorophenyl)methyl]-4-N-(2-methylpropyl)benzene-1,4-dicarboxamide
CID 109043860
N-[(2-chlorophenyl)methyl]-3-methoxybenzamide
CID 790117
N-[(2-chlorophenyl)methyl]-3,5-dimethoxybenzamide
CID 881091
3-methoxy-N-[2-(methylamino)propyl]-4-(2-methylpropoxy)benzamide;hydrochloride
CID 120829798
N-[(2-chlorophenyl)methyl]-2-(3,4-dimethoxyphenyl)-3-methylbutanamide
CID 110300954
N-[(2S)-1-[(2-chlorophenyl)methylamino]-1-oxopropan-2-yl]-3,4,5-trimethoxybenzamide
CID 9209715
4-[(2-chlorophenyl)methoxy]-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methoxybenzamide
CID 47916263

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide (CID 9437289) is N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide is COc1cc(C(=O)NCc2ccccc2Cl)ccc1OCC(C)C.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide?
The InChIKey is SZQWOQPRHQREEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO3/c1-13(2)12-24-17-9-8-14(10-18(17)23-3)19(22)21-11-15-6-4-5-7-16(15)20/h4-10,13H,11-12H2,1-3H3,(H,21,22).
What are the key properties of N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide?
N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide has a molecular weight of 347.84 g/mol, XLogP of 4.31, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-3-methoxy-4-(2-methylpropoxy)benzamide is sourced from PubChem (CID 9437289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).