1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride

C13H25ClN2O — CID 119322718

IUPAC1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride
SMILESCCC1(CNC(=O)C2(N)CCCCC2)CC1.Cl
InChIInChI=1S/C13H24N2O.ClH/c1-2-12(8-9-12)10-15-11(16)13(14)6-4-3-5-7-13;/h2-10,14H2,1H3,(H,15,16);1H
InChIKeyVIOPMXNPFLMIPW-UHFFFAOYSA-N
MW260.81 g/mol
LogP2.38
Rot. Bonds4

About 1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride

1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride (PubChem CID 119322718) has the molecular formula C13H25ClN2O and a molecular weight of 260.81 g/mol. Its IUPAC name is 1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride
PubChem CID119322718
Molecular FormulaC13H25ClN2O
Molecular Weight260.81 g/mol
Exact Mass260.17
IUPAC Name1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride
SMILESCCC1(CNC(=O)C2(N)CCCCC2)CC1.Cl
InChIInChI=1S/C13H24N2O.ClH/c1-2-12(8-9-12)10-15-11(16)13(14)6-4-3-5-7-13;/h2-10,14H2,1H3,(H,15,16);1H
InChIKeyVIOPMXNPFLMIPW-UHFFFAOYSA-N
XLogP2.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.81
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[[1-(2-methylpropyl)cyclopropyl]methyl]cyclopentane-1-carboxamide
CID 119345128
1-amino-N-[[1-(2-hydroxyethyl)cyclopentyl]methyl]cyclopropane-1-carboxamide;hydrochloride
CID 119817790
1-amino-N-[[1-(2-ethoxyethyl)cyclobutyl]methyl]cyclohexane-1-carboxamide
CID 119344511
1-amino-N-[[1-(2-methylpropyl)cyclopropyl]methyl]cyclopropane-1-carboxamide;hydrochloride
CID 119821357
1-amino-N-pentan-3-ylcyclohexane-1-carboxamide;hydrochloride
CID 119263350
N-[(1-ethylcyclopropyl)methyl]-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119945393
1-amino-N-(cyanomethyl)cyclohexane-1-carboxamide
CID 11194684
2-amino-N-[(1-ethylcyclopentyl)methyl]acetamide
CID 103797853
1-amino-N-[(2S)-2-hydroxypropyl]cyclopentane-1-carboxamide
CID 93315414
1-amino-N-(2,2,2-trifluoroethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119291003
2-(4-aminophenyl)-N-[(1-ethylcyclopentyl)methyl]acetamide;hydrochloride
CID 119812218
1-amino-N-[[1-(dimethylamino)cyclopentyl]methyl]cyclobutane-1-carboxamide
CID 83111018

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride (CID 119322718) is 1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride is CCC1(CNC(=O)C2(N)CCCCC2)CC1.Cl.
What is the InChIKey of 1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride?
The InChIKey is VIOPMXNPFLMIPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O.ClH/c1-2-12(8-9-12)10-15-11(16)13(14)6-4-3-5-7-13;/h2-10,14H2,1H3,(H,15,16);1H.
What are the key properties of 1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride?
1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride has a molecular weight of 260.81 g/mol, XLogP of 2.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[(1-ethylcyclopropyl)methyl]cyclohexane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119322718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).