N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide

C16H17ClN2O — CID 86865212

IUPACN-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide
SMILESCCN(C)c1ccc(C(=O)Nc2ccccc2Cl)cc1
InChIInChI=1S/C16H17ClN2O/c1-3-19(2)13-10-8-12(9-11-13)16(20)18-15-7-5-4-6-14(15)17/h4-11H,3H2,1-2H3,(H,18,20)
InChIKeyDXHDTISYNAYGSI-UHFFFAOYSA-N
MW288.78 g/mol
LogP4.05
Rot. Bonds4

About N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide

N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide (PubChem CID 86865212) has the molecular formula C16H17ClN2O and a molecular weight of 288.78 g/mol. Its IUPAC name is N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide
PubChem CID86865212
Molecular FormulaC16H17ClN2O
Molecular Weight288.78 g/mol
Exact Mass288.10
IUPAC NameN-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide
SMILESCCN(C)c1ccc(C(=O)Nc2ccccc2Cl)cc1
InChIInChI=1S/C16H17ClN2O/c1-3-19(2)13-10-8-12(9-11-13)16(20)18-15-7-5-4-6-14(15)17/h4-11H,3H2,1-2H3,(H,18,20)
InChIKeyDXHDTISYNAYGSI-UHFFFAOYSA-N
XLogP4.05
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.78
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-4-(ethylamino)benzamide
CID 62167613
2-chloro-5-[[4-[ethyl(methyl)amino]benzoyl]amino]-N-phenylbenzamide
CID 86954752
4-butan-2-yloxy-N-(2-chlorophenyl)benzamide
CID 17141187
N-(2-chlorophenyl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 41363696
N-(3-chloro-2-methylphenyl)-4-[ethylsulfonyl(methyl)amino]benzamide
CID 21173367
4-N-(2-chlorophenyl)-1-N-prop-2-enylbenzene-1,4-dicarboxamide
CID 109043565
N-(2-chlorophenyl)-4-[(2-methoxyacetyl)amino]benzamide
CID 1228428
N-(2-chlorophenyl)-4-[cyclopropyl(methyl)sulfamoyl]benzamide
CID 41364040
N-(2-chlorophenyl)-4-(octanoylamino)benzamide
CID 171980600
4-N-(2-chlorophenyl)-1-N-[(2-methoxyphenyl)methyl]benzene-1,4-dicarboxamide
CID 109047395
N-(2-chlorophenyl)pyridine-4-carboxamide;hydrochloride
CID 110756414
4-(dimethylamino)-N-[2-(hydroxymethyl)phenyl]benzamide
CID 60653502

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide?
The IUPAC name of N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide (CID 86865212) is N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide.
What is the SMILES notation for N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide?
The canonical SMILES for N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide is CCN(C)c1ccc(C(=O)Nc2ccccc2Cl)cc1.
What is the InChIKey of N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide?
The InChIKey is DXHDTISYNAYGSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O/c1-3-19(2)13-10-8-12(9-11-13)16(20)18-15-7-5-4-6-14(15)17/h4-11H,3H2,1-2H3,(H,18,20).
What are the key properties of N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide?
N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide has a molecular weight of 288.78 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-4-[ethyl(methyl)amino]benzamide is sourced from PubChem (CID 86865212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).