3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride

C15H29ClN2O — CID 119674160

IUPAC3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride
SMILESCCN(C(=O)C1CCCC(N)C1)C1CCCCC1.Cl
InChIInChI=1S/C15H28N2O.ClH/c1-2-17(14-9-4-3-5-10-14)15(18)12-7-6-8-13(16)11-12;/h12-14H,2-11,16H2,1H3;1H
InChIKeyABQQEVUQAVTDCP-UHFFFAOYSA-N
MW288.86 g/mol
LogP3.11
Rot. Bonds3

About 3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride

3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride (PubChem CID 119674160) has the molecular formula C15H29ClN2O and a molecular weight of 288.86 g/mol. Its IUPAC name is 3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride
PubChem CID119674160
Molecular FormulaC15H29ClN2O
Molecular Weight288.86 g/mol
Exact Mass288.20
IUPAC Name3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride
SMILESCCN(C(=O)C1CCCC(N)C1)C1CCCCC1.Cl
InChIInChI=1S/C15H28N2O.ClH/c1-2-17(14-9-4-3-5-10-14)15(18)12-7-6-8-13(16)11-12;/h12-14H,2-11,16H2,1H3;1H
InChIKeyABQQEVUQAVTDCP-UHFFFAOYSA-N
XLogP3.11
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.86
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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ethyl 2-[(3-aminocyclohexanecarbonyl)-cyclopropylamino]acetate
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N-cyclohexyl-N-ethyl-2-methylpiperidine-4-carboxamide
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3-amino-N-(cyclohexylmethyl)-N-propylcyclohexane-1-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride?
The IUPAC name of 3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride (CID 119674160) is 3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride.
What is the SMILES notation for 3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride?
The canonical SMILES for 3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride is CCN(C(=O)C1CCCC(N)C1)C1CCCCC1.Cl.
What is the InChIKey of 3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride?
The InChIKey is ABQQEVUQAVTDCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O.ClH/c1-2-17(14-9-4-3-5-10-14)15(18)12-7-6-8-13(16)11-12;/h12-14H,2-11,16H2,1H3;1H.
What are the key properties of 3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride?
3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride has a molecular weight of 288.86 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-cyclohexyl-N-ethylcyclohexane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119674160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).