2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide

C16H16Cl2N2O — CID 43736518

IUPAC2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide
SMILESCCC(Nc1ccc(C(N)=O)c(Cl)c1)c1cccc(Cl)c1
InChIInChI=1S/C16H16Cl2N2O/c1-2-15(10-4-3-5-11(17)8-10)20-12-6-7-13(16(19)21)14(18)9-12/h3-9,15,20H,2H2,1H3,(H2,19,21)
InChIKeyNPFZIBTXNSWWKD-UHFFFAOYSA-N
MW323.22 g/mol
LogP4.66
Rot. Bonds5

About 2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide

2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide (PubChem CID 43736518) has the molecular formula C16H16Cl2N2O and a molecular weight of 323.22 g/mol. Its IUPAC name is 2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide.

Molecular Properties

Compound Name2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide
PubChem CID43736518
Molecular FormulaC16H16Cl2N2O
Molecular Weight323.22 g/mol
Exact Mass322.06
IUPAC Name2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide
SMILESCCC(Nc1ccc(C(N)=O)c(Cl)c1)c1cccc(Cl)c1
InChIInChI=1S/C16H16Cl2N2O/c1-2-15(10-4-3-5-11(17)8-10)20-12-6-7-13(16(19)21)14(18)9-12/h3-9,15,20H,2H2,1H3,(H2,19,21)
InChIKeyNPFZIBTXNSWWKD-UHFFFAOYSA-N
XLogP4.66
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.22
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-chloro-4-[1-(3-chlorophenyl)propylamino]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

4-[1-(3-chlorophenyl)propylamino]benzamide
CID 43192997
2-chloro-4-[1-(4-methylphenyl)propylamino]benzamide
CID 43736529
4-[1-(3-chlorophenyl)propylamino]benzoic acid
CID 43321653
4-(butan-2-ylamino)-2-chlorobenzamide
CID 43736488
2-fluoro-5-[1-(3-fluorophenyl)propylamino]benzamide
CID 114871265
4-bromo-N-[1-(3-chlorophenyl)propyl]aniline
CID 43101702
4-[1-(3-chlorophenyl)propylamino]-3-methylbenzamide
CID 43706964
5-[1-(3-chlorophenyl)propylamino]-2-methoxyphenol
CID 43743809
N-[3-[1-(3-chlorophenyl)propylamino]phenyl]cyclopropanecarboxamide
CID 112815872
2-chloro-4-[1-(3-methoxyphenyl)ethylamino]benzamide
CID 43736525
2-[1-(3-chlorophenyl)propylamino]-2-methylpropanamide
CID 61210694
N-[1-(3-chlorophenyl)propyl]-4-methoxy-3-methylaniline
CID 63455500

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide?
The IUPAC name of 2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide (CID 43736518) is 2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide.
What is the SMILES notation for 2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide?
The canonical SMILES for 2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide is CCC(Nc1ccc(C(N)=O)c(Cl)c1)c1cccc(Cl)c1.
What is the InChIKey of 2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide?
The InChIKey is NPFZIBTXNSWWKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O/c1-2-15(10-4-3-5-11(17)8-10)20-12-6-7-13(16(19)21)14(18)9-12/h3-9,15,20H,2H2,1H3,(H2,19,21).
What are the key properties of 2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide?
2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide has a molecular weight of 323.22 g/mol, XLogP of 4.66, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-[1-(3-chlorophenyl)propylamino]benzamide is sourced from PubChem (CID 43736518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).