N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide

C16H17ClN2O2 — CID 60680092

IUPACN-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide
SMILESCNc1ccccc1C(=O)Nc1cc(C)c(Cl)cc1OC
InChIInChI=1S/C16H17ClN2O2/c1-10-8-14(15(21-3)9-12(10)17)19-16(20)11-6-4-5-7-13(11)18-2/h4-9,18H,1-3H3,(H,19,20)
InChIKeyKZOYKRAYXKVZGX-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.95
Rot. Bonds4

About N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide

N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide (PubChem CID 60680092) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide
PubChem CID60680092
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC NameN-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide
SMILESCNc1ccccc1C(=O)Nc1cc(C)c(Cl)cc1OC
InChIInChI=1S/C16H17ClN2O2/c1-10-8-14(15(21-3)9-12(10)17)19-16(20)11-6-4-5-7-13(11)18-2/h4-9,18H,1-3H3,(H,19,20)
InChIKeyKZOYKRAYXKVZGX-UHFFFAOYSA-N
XLogP3.95
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chloro-2-methoxy-5-methylphenyl)-2,3-dimethylbenzamide
CID 2107284
CID 90477654
CID 90477654
N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide
CID 107622226
N-(4-chloro-2-methoxy-5-methylphenyl)-2,6-dihydroxybenzamide
CID 107688924
N-(4-chloro-2-methoxy-5-methylphenyl)-2,5-dihydroxybenzamide
CID 103891512
2-chloro-N-(4-chloro-2-methoxy-5-methylphenyl)-4,5-difluorobenzamide
CID 4852133
N-(4-chloro-2-methoxy-5-methylphenyl)-2-[(3R)-pyrrolidin-3-yl]benzamide
CID 95720866
4-[(4-chloro-2-methoxy-5-methylphenyl)carbamoyl]pyridine-3-carboxylic acid
CID 53270694
N-(4-chloro-2-methoxy-5-methylphenyl)-2-methyl-1H-benzimidazole-4-carboxamide
CID 110701135
N-(4-chloro-2-methoxy-5-methylphenyl)-3-methoxy-4-methylbenzamide
CID 9083792
N-(4-chloro-2-methoxy-5-methylphenyl)-4-iodobenzamide
CID 1297130
N-(4-chloro-2-methoxy-5-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 1328482

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide?
The IUPAC name of N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide (CID 60680092) is N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide.
What is the SMILES notation for N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide?
The canonical SMILES for N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide is CNc1ccccc1C(=O)Nc1cc(C)c(Cl)cc1OC.
What is the InChIKey of N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide?
The InChIKey is KZOYKRAYXKVZGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-10-8-14(15(21-3)9-12(10)17)19-16(20)11-6-4-5-7-13(11)18-2/h4-9,18H,1-3H3,(H,19,20).
What are the key properties of N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide?
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide has a molecular weight of 304.78 g/mol, XLogP of 3.95, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methoxy-5-methylphenyl)-2-(methylamino)benzamide is sourced from PubChem (CID 60680092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).