2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide

C15H20ClN3O2 — CID 47075783

IUPAC2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide
SMILESCC(NC(=O)Nc1ccc(Cl)cc1)C(=O)NC1CCCC1
InChIInChI=1S/C15H20ClN3O2/c1-10(14(20)18-12-4-2-3-5-12)17-15(21)19-13-8-6-11(16)7-9-13/h6-10,12H,2-5H2,1H3,(H,18,20)(H2,17,19,21)
InChIKeyHCLFSDWRZMFPMW-UHFFFAOYSA-N
MW309.80 g/mol
LogP2.91
Rot. Bonds4

About 2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide

2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide (PubChem CID 47075783) has the molecular formula C15H20ClN3O2 and a molecular weight of 309.80 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide
PubChem CID47075783
Molecular FormulaC15H20ClN3O2
Molecular Weight309.80 g/mol
Exact Mass309.12
IUPAC Name2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide
SMILESCC(NC(=O)Nc1ccc(Cl)cc1)C(=O)NC1CCCC1
InChIInChI=1S/C15H20ClN3O2/c1-10(14(20)18-12-4-2-3-5-12)17-15(21)19-13-8-6-11(16)7-9-13/h6-10,12H,2-5H2,1H3,(H,18,20)(H2,17,19,21)
InChIKeyHCLFSDWRZMFPMW-UHFFFAOYSA-N
XLogP2.91
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.80
LogP ≤ 52.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-3-cyclododecylurea
CID 19165021
N-cyclopentyl-2-[[3-[[1-(cyclopentylamino)-1-oxopropan-2-yl]carbamoylamino]-4-methylphenyl]carbamoylamino]propanamide
CID 47075790
4-N-(4-chlorophenyl)-1-N-cyclopentylbenzene-1,4-dicarboxamide
CID 109044491
(2R)-2-[(3-cyanophenyl)carbamoylamino]-N-cyclopentylpropanamide
CID 94779767
2-[(3-cyanophenyl)carbamoylamino]-N-cyclopentylpropanamide
CID 47075796
N-cyclopentyl-2-(cyclopropylcarbamoylamino)propanamide
CID 47076626
1-(4-chlorophenyl)-3-(3-methylcyclohexyl)urea
CID 3710204
1-(4-chlorophenyl)-3-[3-[(4-chlorophenyl)carbamoylamino]cyclohexyl]urea
CID 11026212
2-(3-chloro-4-fluoroanilino)-N-cyclohexylpropanamide
CID 78907261
2-[(4-chlorophenyl)carbamoylamino]-N-(2-fluorophenyl)propanamide
CID 110407940
(2S)-2-[(4-chlorophenyl)sulfonylamino]-N-cycloheptylpropanamide
CID 51122843
N'-(4-chlorophenyl)-N-cyclohexylpropanediamide
CID 108942605

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide?
The IUPAC name of 2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide (CID 47075783) is 2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide.
What is the SMILES notation for 2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide?
The canonical SMILES for 2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide is CC(NC(=O)Nc1ccc(Cl)cc1)C(=O)NC1CCCC1.
What is the InChIKey of 2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide?
The InChIKey is HCLFSDWRZMFPMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O2/c1-10(14(20)18-12-4-2-3-5-12)17-15(21)19-13-8-6-11(16)7-9-13/h6-10,12H,2-5H2,1H3,(H,18,20)(H2,17,19,21).
What are the key properties of 2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide?
2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide has a molecular weight of 309.80 g/mol, XLogP of 2.91, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)carbamoylamino]-N-cyclopentylpropanamide is sourced from PubChem (CID 47075783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).