1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride

C12H25ClN2O — CID 119279539

IUPAC1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride
SMILESCC(C)(C)CCNC(=O)C1(N)CCCC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-11(2,3)8-9-14-10(15)12(13)6-4-5-7-12;/h4-9,13H2,1-3H3,(H,14,15);1H
InChIKeyJKYGUUOOJDYCTD-UHFFFAOYSA-N
MW248.80 g/mol
LogP2.23
Rot. Bonds3

About 1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride

1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119279539) has the molecular formula C12H25ClN2O and a molecular weight of 248.80 g/mol. Its IUPAC name is 1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride
PubChem CID119279539
Molecular FormulaC12H25ClN2O
Molecular Weight248.80 g/mol
Exact Mass248.17
IUPAC Name1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride
SMILESCC(C)(C)CCNC(=O)C1(N)CCCC1.Cl
InChIInChI=1S/C12H24N2O.ClH/c1-11(2,3)8-9-14-10(15)12(13)6-4-5-7-12;/h4-9,13H2,1-3H3,(H,14,15);1H
InChIKeyJKYGUUOOJDYCTD-UHFFFAOYSA-N
XLogP2.23
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
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

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CID 119775725
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CID 119322435
1-amino-N-hexadecylcyclopentane-1-carboxamide;hydrochloride
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CID 119830623
methyl 3-[(1-aminocyclohexanecarbonyl)amino]propanoate;hydrochloride
CID 119291127
1-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride
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1-amino-N-[2-(tert-butylamino)-2-oxoethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119272923
1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride
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1-amino-N-[(2S)-2-hydroxypropyl]cyclopentane-1-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride (CID 119279539) is 1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride is CC(C)(C)CCNC(=O)C1(N)CCCC1.Cl.
What is the InChIKey of 1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is JKYGUUOOJDYCTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O.ClH/c1-11(2,3)8-9-14-10(15)12(13)6-4-5-7-12;/h4-9,13H2,1-3H3,(H,14,15);1H.
What are the key properties of 1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride?
1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 248.80 g/mol, XLogP of 2.23, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119279539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).