4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide

C16H31N3O — CID 62782532

IUPAC4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide
SMILESCCN1CCC(N(C)C(=O)C2CCC(N)C(C)C2)CC1
InChIInChI=1S/C16H31N3O/c1-4-19-9-7-14(8-10-19)18(3)16(20)13-5-6-15(17)12(2)11-13/h12-15H,4-11,17H2,1-3H3
InChIKeyHCVQRTGETLHMMX-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.69
Rot. Bonds3

About 4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide

4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide (PubChem CID 62782532) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is 4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide
PubChem CID62782532
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC Name4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide
SMILESCCN1CCC(N(C)C(=O)C2CCC(N)C(C)C2)CC1
InChIInChI=1S/C16H31N3O/c1-4-19-9-7-14(8-10-19)18(3)16(20)13-5-6-15(17)12(2)11-13/h12-15H,4-11,17H2,1-3H3
InChIKeyHCVQRTGETLHMMX-UHFFFAOYSA-N
XLogP1.69
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-N-methylcyclohexane-1-carboxamide
CID 62808188
2-amino-N-(1-ethylpiperidin-4-yl)-N-methylcyclopentane-1-carboxamide
CID 64822922
3-amino-N,4-dimethyl-N-(1-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 62776343
N-(1-ethylpiperidin-4-yl)-N-methylpropanamide
CID 60724468
4-amino-N-[3-(dimethylamino)propyl]-N,3-dimethylcyclohexane-1-carboxamide
CID 55227956
N-(1-ethylpiperidin-4-yl)-N,4-dimethylpyrrolidine-3-carboxamide
CID 55229194
4-amino-N-cyclopentyl-N-(2-hydroxyethyl)-3-methylcyclohexane-1-carboxamide
CID 62781431
4-amino-N-butyl-N-ethyl-3-methylcyclohexane-1-carboxamide
CID 62781326
N-(1-ethylpiperidin-4-yl)-N-methyl-6-oxopiperidine-3-carboxamide
CID 78968206
(2R)-2-amino-N-(1-ethylpiperidin-4-yl)-N-methylpropanamide;dihydrochloride
CID 119841949
N-(1-ethylpiperidin-4-yl)-N,3-dimethylpiperidine-2-carboxamide
CID 62339982
4-amino-N-(3-hydroxybutyl)-N,3-dimethylcyclohexane-1-carboxamide
CID 113499950

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide (CID 62782532) is 4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide is CCN1CCC(N(C)C(=O)C2CCC(N)C(C)C2)CC1.
What is the InChIKey of 4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide?
The InChIKey is HCVQRTGETLHMMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-4-19-9-7-14(8-10-19)18(3)16(20)13-5-6-15(17)12(2)11-13/h12-15H,4-11,17H2,1-3H3.
What are the key properties of 4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide?
4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide has a molecular weight of 281.44 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-ethylpiperidin-4-yl)-N,3-dimethylcyclohexane-1-carboxamide is sourced from PubChem (CID 62782532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).