5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide

C15H20ClN3O2 — CID 131910931

IUPAC5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide
SMILESCCNC(=O)c1cc(NC(=O)C2(N)CCCC2)ccc1Cl
InChIInChI=1S/C15H20ClN3O2/c1-2-18-13(20)11-9-10(5-6-12(11)16)19-14(21)15(17)7-3-4-8-15/h5-6,9H,2-4,7-8,17H2,1H3,(H,18,20)(H,19,21)
InChIKeyNGAMUAJVAIPWPZ-UHFFFAOYSA-N
MW309.80 g/mol
LogP2.30
Rot. Bonds4

About 5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide

5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide (PubChem CID 131910931) has the molecular formula C15H20ClN3O2 and a molecular weight of 309.80 g/mol. Its IUPAC name is 5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide.

Molecular Properties

Compound Name5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide
PubChem CID131910931
Molecular FormulaC15H20ClN3O2
Molecular Weight309.80 g/mol
Exact Mass309.12
IUPAC Name5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide
SMILESCCNC(=O)c1cc(NC(=O)C2(N)CCCC2)ccc1Cl
InChIInChI=1S/C15H20ClN3O2/c1-2-18-13(20)11-9-10(5-6-12(11)16)19-14(21)15(17)7-3-4-8-15/h5-6,9H,2-4,7-8,17H2,1H3,(H,18,20)(H,19,21)
InChIKeyNGAMUAJVAIPWPZ-UHFFFAOYSA-N
XLogP2.30
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.80
LogP ≤ 52.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-[(2-fluorophenyl)methyl]benzamide;hydrochloride
CID 119286595
1-amino-N-(3-chloro-4-methylphenyl)cyclopentane-1-carboxamide
CID 60867567
5-[(1-aminocyclopropanecarbonyl)amino]-2-chlorobenzoic acid
CID 65464876
methyl 4-[(1-aminocyclopentanecarbonyl)amino]-2-chlorobenzoate;hydrochloride
CID 119329511
1-amino-N-(4-chloro-3-fluorophenyl)cyclobutane-1-carboxamide
CID 81179055
1-amino-N-(3-chloro-4-ethoxyphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119285029
1-amino-N-(4-propylphenyl)cyclopentane-1-carboxamide
CID 54925144
1-amino-N-(4-ethylphenyl)cyclopentane-1-carboxamide
CID 60867224
N-(4-acetamido-3-chlorophenyl)-1-aminocyclohexane-1-carboxamide;hydrochloride
CID 119276950
N-[4-chloro-3-(ethylcarbamoyl)phenyl]-2,3-difluoro-4-methylbenzamide
CID 131944998
5-[(1-aminocyclopentanecarbonyl)amino]-N,N,2-trimethylbenzamide;hydrochloride
CID 119337791
1-amino-N-[3-chloro-4-(dimethylamino)phenyl]cyclobutane-1-carboxamide
CID 81171852

Frequently Asked Questions

What is the IUPAC name of 5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide?
The IUPAC name of 5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide (CID 131910931) is 5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide.
What is the SMILES notation for 5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide?
The canonical SMILES for 5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide is CCNC(=O)c1cc(NC(=O)C2(N)CCCC2)ccc1Cl.
What is the InChIKey of 5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide?
The InChIKey is NGAMUAJVAIPWPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O2/c1-2-18-13(20)11-9-10(5-6-12(11)16)19-14(21)15(17)7-3-4-8-15/h5-6,9H,2-4,7-8,17H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide?
5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide has a molecular weight of 309.80 g/mol, XLogP of 2.30, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1-aminocyclopentanecarbonyl)amino]-2-chloro-N-ethylbenzamide is sourced from PubChem (CID 131910931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).