1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride

C14H29ClN2O — CID 119344457

IUPAC1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride
SMILESCC(C)CC(C)(C)CNC(=O)C1(N)CCCC1.Cl
InChIInChI=1S/C14H28N2O.ClH/c1-11(2)9-13(3,4)10-16-12(17)14(15)7-5-6-8-14;/h11H,5-10,15H2,1-4H3,(H,16,17);1H
InChIKeyIYYADDAQIYEOOJ-UHFFFAOYSA-N
MW276.85 g/mol
LogP2.87
Rot. Bonds5

About 1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride

1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119344457) has the molecular formula C14H29ClN2O and a molecular weight of 276.85 g/mol. Its IUPAC name is 1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride
PubChem CID119344457
Molecular FormulaC14H29ClN2O
Molecular Weight276.85 g/mol
Exact Mass276.20
IUPAC Name1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride
SMILESCC(C)CC(C)(C)CNC(=O)C1(N)CCCC1.Cl
InChIInChI=1S/C14H28N2O.ClH/c1-11(2)9-13(3,4)10-16-12(17)14(15)7-5-6-8-14;/h11H,5-10,15H2,1-4H3,(H,16,17);1H
InChIKeyIYYADDAQIYEOOJ-UHFFFAOYSA-N
XLogP2.87
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.85
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-(2-hydroxy-2,4-dimethylpentyl)cyclopropane-1-carboxamide
CID 66172259
4-methoxy-N-(2,2,4-trimethylpentyl)piperidine-4-carboxamide;hydrochloride
CID 119820271
1-amino-N-(3-methylbutyl)cyclopentane-1-carboxamide
CID 60866848
(2S)-2-amino-N-(2,2,4-trimethylpentyl)propanamide;hydrochloride
CID 119344448
1-amino-N-[2-(dimethylamino)-2-methylpropyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119830623
1-amino-N-(3,3-dimethylbutyl)cyclopentane-1-carboxamide;hydrochloride
CID 119279539
1-amino-N-[(2S)-2-hydroxypropyl]cyclopentane-1-carboxamide
CID 93315414
1-amino-N-(2-bromo-2,2-difluoroethyl)cyclopentane-1-carboxamide
CID 130551943
1-amino-N-(2,2,2-trifluoroethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119291003
1-amino-N-[[1-(2-methylpropyl)cyclopropyl]methyl]cyclopentane-1-carboxamide
CID 119345128
1-amino-N-(2,2-dimethyl-3-phenylpropyl)cyclopentane-1-carboxamide
CID 119329656
1-amino-N-(3-methylbutyl)cyclobutane-1-carboxamide
CID 81167864

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride (CID 119344457) is 1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride is CC(C)CC(C)(C)CNC(=O)C1(N)CCCC1.Cl.
What is the InChIKey of 1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is IYYADDAQIYEOOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O.ClH/c1-11(2)9-13(3,4)10-16-12(17)14(15)7-5-6-8-14;/h11H,5-10,15H2,1-4H3,(H,16,17);1H.
What are the key properties of 1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride?
1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 276.85 g/mol, XLogP of 2.87, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(2,2,4-trimethylpentyl)cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119344457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).