N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide

C14H13ClN2O2 — CID 23464385

IUPACN-(3-amino-4-methoxyphenyl)-2-chlorobenzamide
SMILESCOc1ccc(NC(=O)c2ccccc2Cl)cc1N
InChIInChI=1S/C14H13ClN2O2/c1-19-13-7-6-9(8-12(13)16)17-14(18)10-4-2-3-5-11(10)15/h2-8H,16H2,1H3,(H,17,18)
InChIKeyNFYBCKQFCKDFLI-UHFFFAOYSA-N
MW276.72 g/mol
LogP3.18
Rot. Bonds3

About N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide

N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide (PubChem CID 23464385) has the molecular formula C14H13ClN2O2 and a molecular weight of 276.72 g/mol. Its IUPAC name is N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide.

Molecular Properties

Compound NameN-(3-amino-4-methoxyphenyl)-2-chlorobenzamide
PubChem CID23464385
Molecular FormulaC14H13ClN2O2
Molecular Weight276.72 g/mol
Exact Mass276.07
IUPAC NameN-(3-amino-4-methoxyphenyl)-2-chlorobenzamide
SMILESCOc1ccc(NC(=O)c2ccccc2Cl)cc1N
InChIInChI=1S/C14H13ClN2O2/c1-19-13-7-6-9(8-12(13)16)17-14(18)10-4-2-3-5-11(10)15/h2-8H,16H2,1H3,(H,17,18)
InChIKeyNFYBCKQFCKDFLI-UHFFFAOYSA-N
XLogP3.18
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(3-amino-4-methoxyphenyl)-5-chloro-2-methoxybenzamide
CID 43599928
N-(3-amino-4-methoxyphenyl)-2-chloro-5-methylsulfanylbenzamide
CID 61379591
N-(3-amino-4-ethoxyphenyl)-2-methoxybenzamide
CID 70635969
N-(3-amino-4-methoxyphenyl)benzamide;molecular nitrogen
CID 174994775
4-amino-2-chloro-5-methoxy-N-phenylbenzamide
CID 66664690
N-(3-amino-4-methoxyphenyl)-5-(tert-butylcarbamoylamino)-2-chlorobenzamide
CID 119419296
N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide
CID 70635725
5-chloro-N-[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]-2-methoxybenzamide
CID 17111377
N-(3-amino-4-methoxyphenyl)-2-[cyclopropanecarbonyl(methyl)amino]benzamide;hydrochloride
CID 119420415
3-amino-N-(4-chloro-3-methoxyphenyl)-4-methoxybenzamide
CID 107620662
N-(3-amino-4-methoxyphenyl)-3-bromo-4-chlorobenzamide
CID 107990051
N-(3-amino-4-methoxyphenyl)-2-morpholin-4-ylsulfonylbenzamide
CID 119419992

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide?
The IUPAC name of N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide (CID 23464385) is N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide.
What is the SMILES notation for N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide?
The canonical SMILES for N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide is COc1ccc(NC(=O)c2ccccc2Cl)cc1N.
What is the InChIKey of N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide?
The InChIKey is NFYBCKQFCKDFLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O2/c1-19-13-7-6-9(8-12(13)16)17-14(18)10-4-2-3-5-11(10)15/h2-8H,16H2,1H3,(H,17,18).
What are the key properties of N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide?
N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide has a molecular weight of 276.72 g/mol, XLogP of 3.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide is sourced from PubChem (CID 23464385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).