N-(5-amino-2-chlorophenyl)-2-methylbenzamide

C14H13ClN2O — CID 28866784

IUPACN-(5-amino-2-chlorophenyl)-2-methylbenzamide
SMILESCc1ccccc1C(=O)Nc1cc(N)ccc1Cl
InChIInChI=1S/C14H13ClN2O/c1-9-4-2-3-5-11(9)14(18)17-13-8-10(16)6-7-12(13)15/h2-8H,16H2,1H3,(H,17,18)
InChIKeyUIZFDXQAGINMQV-UHFFFAOYSA-N
MW260.72 g/mol
LogP3.48
Rot. Bonds2

About N-(5-amino-2-chlorophenyl)-2-methylbenzamide

N-(5-amino-2-chlorophenyl)-2-methylbenzamide (PubChem CID 28866784) has the molecular formula C14H13ClN2O and a molecular weight of 260.72 g/mol. Its IUPAC name is N-(5-amino-2-chlorophenyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(5-amino-2-chlorophenyl)-2-methylbenzamide
PubChem CID28866784
Molecular FormulaC14H13ClN2O
Molecular Weight260.72 g/mol
Exact Mass260.07
IUPAC NameN-(5-amino-2-chlorophenyl)-2-methylbenzamide
SMILESCc1ccccc1C(=O)Nc1cc(N)ccc1Cl
InChIInChI=1S/C14H13ClN2O/c1-9-4-2-3-5-11(9)14(18)17-13-8-10(16)6-7-12(13)15/h2-8H,16H2,1H3,(H,17,18)
InChIKeyUIZFDXQAGINMQV-UHFFFAOYSA-N
XLogP3.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.72
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[4-amino-2-chloro-5-(dimethylamino)phenyl]-2-methylbenzamide
CID 50881169
N-(7-chloro-1,4-dimethyl-2,3-dioxoquinoxalin-6-yl)-2-methylbenzamide
CID 46249057
5-amino-N-(5-bromo-2-chlorophenyl)-2-methylbenzamide
CID 62913176
N-(2-chloro-4-methylphenyl)-2-methylbenzamide
CID 2540447
N-(4-amino-2-chlorophenyl)-2,3-dimethylbenzamide
CID 16788699
N-(5-amino-2-chlorophenyl)-3-methylpyridine-2-carboxamide
CID 55059942
N-(2-chloro-4-hydroxyphenyl)-2-methylbenzamide
CID 64787154
5-amino-N-(2,5-dichloro-4-methylphenyl)-2-methylbenzamide
CID 104725719
N-(4-amino-2-chlorophenyl)-2-chlorobenzamide
CID 960633
(E)-3-[4-chloro-3-[(2-methylbenzoyl)amino]phenyl]prop-2-enoic acid
CID 91688659
N-(5-amino-2-chlorophenyl)-5-bromo-2-chlorobenzamide
CID 43548736
(5-amino-2-chlorophenyl)carbamic acid
CID 57203171

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-chlorophenyl)-2-methylbenzamide?
The IUPAC name of N-(5-amino-2-chlorophenyl)-2-methylbenzamide (CID 28866784) is N-(5-amino-2-chlorophenyl)-2-methylbenzamide.
What is the SMILES notation for N-(5-amino-2-chlorophenyl)-2-methylbenzamide?
The canonical SMILES for N-(5-amino-2-chlorophenyl)-2-methylbenzamide is Cc1ccccc1C(=O)Nc1cc(N)ccc1Cl.
What is the InChIKey of N-(5-amino-2-chlorophenyl)-2-methylbenzamide?
The InChIKey is UIZFDXQAGINMQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O/c1-9-4-2-3-5-11(9)14(18)17-13-8-10(16)6-7-12(13)15/h2-8H,16H2,1H3,(H,17,18).
What are the key properties of N-(5-amino-2-chlorophenyl)-2-methylbenzamide?
N-(5-amino-2-chlorophenyl)-2-methylbenzamide has a molecular weight of 260.72 g/mol, XLogP of 3.48, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-chlorophenyl)-2-methylbenzamide is sourced from PubChem (CID 28866784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).