2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide

C12H17ClN2O — CID 60788357

IUPAC2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide
SMILESCC(C)NC(C)(C(N)=O)c1ccccc1Cl
InChIInChI=1S/C12H17ClN2O/c1-8(2)15-12(3,11(14)16)9-6-4-5-7-10(9)13/h4-8,15H,1-3H3,(H2,14,16)
InChIKeyCQVUNQPEDTWKGY-UHFFFAOYSA-N
MW240.73 g/mol
LogP2.04
Rot. Bonds4

About 2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide

2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide (PubChem CID 60788357) has the molecular formula C12H17ClN2O and a molecular weight of 240.73 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide
PubChem CID60788357
Molecular FormulaC12H17ClN2O
Molecular Weight240.73 g/mol
Exact Mass240.10
IUPAC Name2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide
SMILESCC(C)NC(C)(C(N)=O)c1ccccc1Cl
InChIInChI=1S/C12H17ClN2O/c1-8(2)15-12(3,11(14)16)9-6-4-5-7-10(9)13/h4-8,15H,1-3H3,(H2,14,16)
InChIKeyCQVUNQPEDTWKGY-UHFFFAOYSA-N
XLogP2.04
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.73
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide 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

2-(2,4-dichlorophenyl)-2-(propan-2-ylamino)propanamide
CID 54918479
2-[2-(difluoromethoxy)phenyl]-2-(propan-2-ylamino)propanamide
CID 54918576
2-(2-chlorophenyl)-2-(2-methylanilino)propanamide
CID 60996305
2,2-bis(2-chlorophenyl)propanediamide
CID 118221766
2-(2-chlorophenyl)-2-(1-thiophen-2-ylethylamino)propanoic acid
CID 66925893
2-(3,5-dihydroxyphenyl)-2-(propan-2-ylamino)propanamide
CID 107707483
3-(2-chlorophenyl)-3-fluoro-2-methylbutanoic acid
CID 105488759
2-(2-chloroanilino)-2-phenylpropanamide
CID 54891167
methyl 4-amino-3-(2-chlorophenyl)-3,4-dimethylpentanoate
CID 66096712
ethyl 2-(2-chlorophenyl)-2-(methylamino)propanoate
CID 60788388
(2S)-2-(2-chlorophenyl)-2-(ethylamino)propanoic acid
CID 93280138
2-(2-chlorophenyl)propan-2-ol
CID 12759846

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide?
The IUPAC name of 2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide (CID 60788357) is 2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide.
What is the SMILES notation for 2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide?
The canonical SMILES for 2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide is CC(C)NC(C)(C(N)=O)c1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide?
The InChIKey is CQVUNQPEDTWKGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O/c1-8(2)15-12(3,11(14)16)9-6-4-5-7-10(9)13/h4-8,15H,1-3H3,(H2,14,16).
What are the key properties of 2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide?
2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide has a molecular weight of 240.73 g/mol, XLogP of 2.04, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-2-(propan-2-ylamino)propanamide is sourced from PubChem (CID 60788357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).