1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide

C15H28N2O — CID 54880967

IUPAC1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide
SMILESCCC1CCC(CNC(=O)C2(N)CCCC2)CC1
InChIInChI=1S/C15H28N2O/c1-2-12-5-7-13(8-6-12)11-17-14(18)15(16)9-3-4-10-15/h12-13H,2-11,16H2,1H3,(H,17,18)
InChIKeyPZCDDPWQAGMDCB-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.59
Rot. Bonds4

About 1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide

1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide (PubChem CID 54880967) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide
PubChem CID54880967
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide
SMILESCCC1CCC(CNC(=O)C2(N)CCCC2)CC1
InChIInChI=1S/C15H28N2O/c1-2-12-5-7-13(8-6-12)11-17-14(18)15(16)9-3-4-10-15/h12-13H,2-11,16H2,1H3,(H,17,18)
InChIKeyPZCDDPWQAGMDCB-UHFFFAOYSA-N
XLogP2.59
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[(4-ethylcyclohexyl)methyl]-3-methylcyclohexane-1-carboxamide
CID 64554630
1-amino-N-[(4-hydroxycyclohexyl)methyl]cyclobutane-1-carboxamide
CID 106135620
1-amino-N-(cyclopentylmethyl)cyclopropane-1-carboxamide
CID 65463779
1-amino-N-[(1-methylpiperidin-4-yl)methyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119866892
1-amino-N-(oxan-4-ylmethyl)cyclohexane-1-carboxamide
CID 63706981
1-amino-N-(oxan-4-ylmethyl)cyclobutane-1-carboxamide
CID 81168701
1-amino-N-[(1-methylpiperidin-4-yl)methyl]cyclopropane-1-carboxamide
CID 65465788
1-amino-N-[[(3R)-1-methylpyrrolidin-3-yl]methyl]cyclobutane-1-carboxamide
CID 95228987
1-amino-N-(cyclobutylmethyl)-3-methylcyclohexane-1-carboxamide
CID 64550637
1-amino-N-[(3-methylcyclohexyl)methyl]cyclopropane-1-carboxamide
CID 103809810
N-[(4-hydroxycyclohexyl)methyl]-1-methylcyclopentane-1-carboxamide
CID 114146551
1-[(4-ethylcyclohexyl)methyl]-3-[[1-(hydroxymethyl)cyclopropyl]methyl]urea
CID 111618683

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide (CID 54880967) is 1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide is CCC1CCC(CNC(=O)C2(N)CCCC2)CC1.
What is the InChIKey of 1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide?
The InChIKey is PZCDDPWQAGMDCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-2-12-5-7-13(8-6-12)11-17-14(18)15(16)9-3-4-10-15/h12-13H,2-11,16H2,1H3,(H,17,18).
What are the key properties of 1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide?
1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide has a molecular weight of 252.40 g/mol, XLogP of 2.59, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[(4-ethylcyclohexyl)methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 54880967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).