1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide

C13H24N2O — CID 61002718

IUPAC1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide
SMILESCC1CCC(NC2CCCC2)(C(N)=O)CC1
InChIInChI=1S/C13H24N2O/c1-10-6-8-13(9-7-10,12(14)16)15-11-4-2-3-5-11/h10-11,15H,2-9H2,1H3,(H2,14,16)
InChIKeyRSRCDYPCDXXJRW-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.95
Rot. Bonds3

About 1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide

1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide (PubChem CID 61002718) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide
PubChem CID61002718
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide
SMILESCC1CCC(NC2CCCC2)(C(N)=O)CC1
InChIInChI=1S/C13H24N2O/c1-10-6-8-13(9-7-10,12(14)16)15-11-4-2-3-5-11/h10-11,15H,2-9H2,1H3,(H2,14,16)
InChIKeyRSRCDYPCDXXJRW-UHFFFAOYSA-N
XLogP1.95
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide?
The IUPAC name of 1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide (CID 61002718) is 1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide?
The canonical SMILES for 1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide is CC1CCC(NC2CCCC2)(C(N)=O)CC1.
What is the InChIKey of 1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide?
The InChIKey is RSRCDYPCDXXJRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-10-6-8-13(9-7-10,12(14)16)15-11-4-2-3-5-11/h10-11,15H,2-9H2,1H3,(H2,14,16).
What are the key properties of 1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide?
1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide has a molecular weight of 224.35 g/mol, XLogP of 1.95, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylamino)-4-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 61002718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).