3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride

C15H29ClN2O — CID 119791924

IUPAC3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride
SMILESCN(C(=O)C1CCC(N)C1)C1CCC(C)(C)CC1.Cl
InChIInChI=1S/C15H28N2O.ClH/c1-15(2)8-6-13(7-9-15)17(3)14(18)11-4-5-12(16)10-11;/h11-13H,4-10,16H2,1-3H3;1H
InChIKeyNNALZXKZHJBEGK-UHFFFAOYSA-N
MW288.86 g/mol
LogP2.96
Rot. Bonds2

About 3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride

3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride (PubChem CID 119791924) has the molecular formula C15H29ClN2O and a molecular weight of 288.86 g/mol. Its IUPAC name is 3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride
PubChem CID119791924
Molecular FormulaC15H29ClN2O
Molecular Weight288.86 g/mol
Exact Mass288.20
IUPAC Name3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride
SMILESCN(C(=O)C1CCC(N)C1)C1CCC(C)(C)CC1.Cl
InChIInChI=1S/C15H28N2O.ClH/c1-15(2)8-6-13(7-9-15)17(3)14(18)11-4-5-12(16)10-11;/h11-13H,4-10,16H2,1-3H3;1H
InChIKeyNNALZXKZHJBEGK-UHFFFAOYSA-N
XLogP2.96
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.86
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-cyclopentyl-N-methylcyclopentane-1-carboxamide;hydrochloride
CID 119696942
3-amino-N-cyclooctyl-N-methylcyclopentane-1-carboxamide
CID 119763854
3-amino-N-cyclopentyl-N-methylcyclohexane-1-carboxamide;hydrochloride
CID 119696948
3-amino-N-methyl-N-(2-methylcyclohexyl)cyclopentane-1-carboxamide
CID 66008967
3-amino-N-methyl-N-(oxolan-3-yl)cyclopentane-1-carboxamide
CID 81489575
3-amino-N-methyl-N-(thiolan-3-yl)cyclopentane-1-carboxamide
CID 66031482
3-amino-N-methyl-N-(2-methylsulfonylcyclohexyl)cyclopentane-1-carboxamide;hydrochloride
CID 119803169
3-amino-N-methyl-N-propylcyclopentane-1-carboxamide
CID 66031475
3-amino-N-(2-hydroxypropyl)-N-methylcyclopentane-1-carboxamide
CID 66007556
3-amino-N-methyl-N-(oxolan-3-yl)cyclohexane-1-carboxamide;hydrochloride
CID 119775453
3-amino-N-[(1-hydroxycyclopentyl)methyl]-N-methylcyclopentane-1-carboxamide
CID 114949026
(2S)-2-amino-N-(4,4-dimethylcyclohexyl)-N-methylpropanamide;hydrochloride
CID 119328237

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride (CID 119791924) is 3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride is CN(C(=O)C1CCC(N)C1)C1CCC(C)(C)CC1.Cl.
What is the InChIKey of 3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride?
The InChIKey is NNALZXKZHJBEGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O.ClH/c1-15(2)8-6-13(7-9-15)17(3)14(18)11-4-5-12(16)10-11;/h11-13H,4-10,16H2,1-3H3;1H.
What are the key properties of 3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride?
3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride has a molecular weight of 288.86 g/mol, XLogP of 2.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4,4-dimethylcyclohexyl)-N-methylcyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119791924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).