1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride

C12H24ClN3O2 — CID 119301742

IUPAC1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCCCNC(=O)CCNC(=O)C1(N)CCCC1.Cl
InChIInChI=1S/C12H23N3O2.ClH/c1-2-8-14-10(16)5-9-15-11(17)12(13)6-3-4-7-12;/h2-9,13H2,1H3,(H,14,16)(H,15,17);1H
InChIKeyJKSXZUJZOCVQMD-UHFFFAOYSA-N
MW277.80 g/mol
LogP0.71
Rot. Bonds6

About 1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride

1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119301742) has the molecular formula C12H24ClN3O2 and a molecular weight of 277.80 g/mol. Its IUPAC name is 1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride
PubChem CID119301742
Molecular FormulaC12H24ClN3O2
Molecular Weight277.80 g/mol
Exact Mass277.16
IUPAC Name1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCCCNC(=O)CCNC(=O)C1(N)CCCC1.Cl
InChIInChI=1S/C12H23N3O2.ClH/c1-2-8-14-10(16)5-9-15-11(17)12(13)6-3-4-7-12;/h2-9,13H2,1H3,(H,14,16)(H,15,17);1H
InChIKeyJKSXZUJZOCVQMD-UHFFFAOYSA-N
XLogP0.71
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.80
LogP ≤ 50.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-(1-aminocyclobutyl)acetyl]amino]-N-propylpropanamide
CID 79853865
1-cyano-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide
CID 47354865
1-amino-N-hexadecylcyclopentane-1-carboxamide;hydrochloride
CID 162369758
1-amino-N-[3-oxo-3-(propan-2-ylamino)propyl]cyclopropane-1-carboxamide;hydrochloride
CID 119703846
methyl 3-[(1-aminocyclohexanecarbonyl)amino]propanoate;hydrochloride
CID 119291127
1-amino-N-(3-amino-3-oxopropyl)cyclohexane-1-carboxamide
CID 43553625
1-amino-N-[3-(cyclohexylamino)-3-oxopropyl]cyclopentane-1-carboxamide;hydrochloride
CID 119299492
ethyl 3-[(1-aminocyclobutanecarbonyl)amino]propanoate
CID 81169398
1-amino-N-pentylcyclobutane-1-carboxamide
CID 81167514
ethyl 3-[(1-aminocyclopropanecarbonyl)amino]propanoate;hydrochloride
CID 119708251
1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride
CID 119279539
1-(aminomethyl)-4-methyl-N-[3-oxo-3-(propylamino)propyl]cyclohexane-1-carboxamide
CID 115442026

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride (CID 119301742) is 1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride is CCCNC(=O)CCNC(=O)C1(N)CCCC1.Cl.
What is the InChIKey of 1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is JKSXZUJZOCVQMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2.ClH/c1-2-8-14-10(16)5-9-15-11(17)12(13)6-3-4-7-12;/h2-9,13H2,1H3,(H,14,16)(H,15,17);1H.
What are the key properties of 1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride?
1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 277.80 g/mol, XLogP of 0.71, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119301742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).