1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride

C12H25ClN2O — CID 119300951

IUPAC1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride
SMILESCCC(C)C(C)NC(=O)C1(N)CCCC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-4-9(2)10(3)14-11(15)12(13)7-5-6-8-12;/h9-10H,4-8,13H2,1-3H3,(H,14,15);1H
InChIKeyVQHRCZDKHHVRQH-UHFFFAOYSA-N
MW248.80 g/mol
LogP2.23
Rot. Bonds4

About 1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride

1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119300951) has the molecular formula C12H25ClN2O and a molecular weight of 248.80 g/mol. Its IUPAC name is 1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride
PubChem CID119300951
Molecular FormulaC12H25ClN2O
Molecular Weight248.80 g/mol
Exact Mass248.17
IUPAC Name1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride
SMILESCCC(C)C(C)NC(=O)C1(N)CCCC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-4-9(2)10(3)14-11(15)12(13)7-5-6-8-12;/h9-10H,4-8,13H2,1-3H3,(H,14,15);1H
InChIKeyVQHRCZDKHHVRQH-UHFFFAOYSA-N
XLogP2.23
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.80
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-[(1-aminocyclopentanecarbonyl)amino]-3-methylpentanoic acid
CID 61174176
1-amino-N-pentan-3-ylcyclohexane-1-carboxamide;hydrochloride
CID 119263350
1-amino-N-[(2R)-1-hydroxybutan-2-yl]cyclopentane-1-carboxamide
CID 93315413
1-amino-N-(5-methylhexan-2-yl)cyclohexane-1-carboxamide;hydrochloride
CID 119263591
1-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)cyclohexane-1-carboxamide
CID 106344921
1-amino-N-(4-methoxybutan-2-yl)cyclopentane-1-carboxamide
CID 64606072
1-amino-N-(4-ethylsulfanylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride
CID 119327797
1-amino-N-(4-hydroxy-3-methylsulfanylbutan-2-yl)cyclohexane-1-carboxamide
CID 106161442
1-amino-N-[(2S)-1-amino-1-oxopropan-2-yl]cyclopentane-1-carboxamide
CID 93315430
1-amino-N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]cyclopentane-1-carboxamide;hydrochloride
CID 119327569
1-amino-N-(1-ethoxypropan-2-yl)cyclobutane-1-carboxamide
CID 81168256
methyl 2-[(1-aminocyclobutanecarbonyl)amino]propanoate
CID 81169291

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride (CID 119300951) is 1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride is CCC(C)C(C)NC(=O)C1(N)CCCC1.Cl.
What is the InChIKey of 1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is VQHRCZDKHHVRQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O.ClH/c1-4-9(2)10(3)14-11(15)12(13)7-5-6-8-12;/h9-10H,4-8,13H2,1-3H3,(H,14,15);1H.
What are the key properties of 1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride?
1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 248.80 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(3-methylpentan-2-yl)cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119300951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).