2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide

C19H20ClN3O2 — CID 47093307

IUPAC2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide
SMILESO=C(Nc1cccc(Cl)c1)NC(Cc1ccccc1)C(=O)NC1CC1
InChIInChI=1S/C19H20ClN3O2/c20-14-7-4-8-16(12-14)22-19(25)23-17(18(24)21-15-9-10-15)11-13-5-2-1-3-6-13/h1-8,12,15,17H,9-11H2,(H,21,24)(H2,22,23,25)
InChIKeySTTUGHWTQASIRE-UHFFFAOYSA-N
MW357.84 g/mol
LogP3.35
Rot. Bonds6

About 2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide

2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide (PubChem CID 47093307) has the molecular formula C19H20ClN3O2 and a molecular weight of 357.84 g/mol. Its IUPAC name is 2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide.

Molecular Properties

Compound Name2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide
PubChem CID47093307
Molecular FormulaC19H20ClN3O2
Molecular Weight357.84 g/mol
Exact Mass357.12
IUPAC Name2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide
SMILESO=C(Nc1cccc(Cl)c1)NC(Cc1ccccc1)C(=O)NC1CC1
InChIInChI=1S/C19H20ClN3O2/c20-14-7-4-8-16(12-14)22-19(25)23-17(18(24)21-15-9-10-15)11-13-5-2-1-3-6-13/h1-8,12,15,17H,9-11H2,(H,21,24)(H2,22,23,25)
InChIKeySTTUGHWTQASIRE-UHFFFAOYSA-N
XLogP3.35
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.84
LogP ≤ 53.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide 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

(2R)-N-cyclopropyl-2-[(3-ethynylphenyl)carbamoylamino]-3-phenylpropanamide
CID 95342005
(2R)-N-cyclopropyl-3-phenyl-2-(pyridin-4-ylcarbamoylamino)propanamide
CID 94798428
(2S)-N-cyclopropyl-2-(naphthalen-1-ylcarbamoylamino)-3-phenylpropanamide
CID 52506751
prop-2-enyl (2R)-2-[(3-chlorophenyl)carbamoylamino]-3-phenylpropanoate
CID 40626177
N-cyclopropyl-2-[(2,4-difluorophenyl)carbamoylamino]-3-phenylpropanamide
CID 47093309
N-benzyl-2-[(3-chlorophenyl)carbamoylamino]-3-phenyl-N-(2-phenylethyl)propanamide
CID 10229409
2-[(3,5-dichlorophenyl)carbamoylamino]-3-phenylpropanoic acid
CID 4032418
(2S)-N-(3-chlorophenyl)-2-methyl-3-phenylpropanamide
CID 56610654
1-(3-chlorophenyl)-3-[2-(cyclohexylcarbamoylamino)-1,2-diphenylethyl]urea
CID 54262033
1-(3-chlorophenyl)-3-[(1R,2S)-2-(cyclohexylcarbamoylamino)-1,2-diphenylethyl]urea
CID 57171555
1-(3-chlorophenyl)-3-[4-(methylamino)cyclohexyl]urea
CID 79110382
(2R)-3-phenyl-2-(phenylcarbamoylamino)propanoic acid
CID 676399

Frequently Asked Questions

What is the IUPAC name of 2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide?
The IUPAC name of 2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide (CID 47093307) is 2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide.
What is the SMILES notation for 2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide?
The canonical SMILES for 2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide is O=C(Nc1cccc(Cl)c1)NC(Cc1ccccc1)C(=O)NC1CC1.
What is the InChIKey of 2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide?
The InChIKey is STTUGHWTQASIRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O2/c20-14-7-4-8-16(12-14)22-19(25)23-17(18(24)21-15-9-10-15)11-13-5-2-1-3-6-13/h1-8,12,15,17H,9-11H2,(H,21,24)(H2,22,23,25).
What are the key properties of 2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide?
2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide has a molecular weight of 357.84 g/mol, XLogP of 3.35, 6 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chlorophenyl)carbamoylamino]-N-cyclopropyl-3-phenylpropanamide is sourced from PubChem (CID 47093307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).