2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide

C15H14Cl2N2O — CID 60996711

IUPAC2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide
SMILESCC(Nc1cccc(Cl)c1)(C(N)=O)c1ccc(Cl)cc1
InChIInChI=1S/C15H14Cl2N2O/c1-15(14(18)20,10-5-7-11(16)8-6-10)19-13-4-2-3-12(17)9-13/h2-9,19H,1H3,(H2,18,20)
InChIKeyNOPVEJVHLVDRNZ-UHFFFAOYSA-N
MW309.20 g/mol
LogP3.81
Rot. Bonds4

About 2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide

2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide (PubChem CID 60996711) has the molecular formula C15H14Cl2N2O and a molecular weight of 309.20 g/mol. Its IUPAC name is 2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide.

Molecular Properties

Compound Name2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide
PubChem CID60996711
Molecular FormulaC15H14Cl2N2O
Molecular Weight309.20 g/mol
Exact Mass308.05
IUPAC Name2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide
SMILESCC(Nc1cccc(Cl)c1)(C(N)=O)c1ccc(Cl)cc1
InChIInChI=1S/C15H14Cl2N2O/c1-15(14(18)20,10-5-7-11(16)8-6-10)19-13-4-2-3-12(17)9-13/h2-9,19H,1H3,(H2,18,20)
InChIKeyNOPVEJVHLVDRNZ-UHFFFAOYSA-N
XLogP3.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.20
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chloroanilino)-2-(4-chlorophenyl)butanamide
CID 60996840
2-(3-chloroanilino)-2-(2,4-difluorophenyl)propanamide
CID 60996710
2-(4-bromoanilino)-2-(4-chlorophenyl)propanamide
CID 60991718
2-(4-chloroanilino)-2-(3-fluorophenyl)propanamide
CID 60991447
2-(3-bromophenyl)-2-(4-chloroanilino)propanamide
CID 60992656
2-(3-bromoanilino)-2-(3,4-dichlorophenyl)propanamide
CID 60992379
2-(3-bromoanilino)-2-(4-bromophenyl)propanamide
CID 60992244
2-(3,4-difluorophenyl)-2-(3-methylanilino)propanamide
CID 60996874
methyl 2-(3-chloroanilino)-2-phenylpropanoate
CID 60991426
2-(3-chloroanilino)-2-(4-ethylphenyl)propanoic acid
CID 60990853
methyl 2-(4-chlorophenyl)-2-(3-methylanilino)propanoate
CID 60993351
2-(3-bromoanilino)-2-(4-methylphenyl)propanamide
CID 60991987

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide?
The IUPAC name of 2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide (CID 60996711) is 2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide.
What is the SMILES notation for 2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide?
The canonical SMILES for 2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide is CC(Nc1cccc(Cl)c1)(C(N)=O)c1ccc(Cl)cc1.
What is the InChIKey of 2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide?
The InChIKey is NOPVEJVHLVDRNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O/c1-15(14(18)20,10-5-7-11(16)8-6-10)19-13-4-2-3-12(17)9-13/h2-9,19H,1H3,(H2,18,20).
What are the key properties of 2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide?
2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide has a molecular weight of 309.20 g/mol, XLogP of 3.81, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloroanilino)-2-(4-chlorophenyl)propanamide is sourced from PubChem (CID 60996711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).