2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide

C15H28N2O — CID 65455288

IUPAC2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide
SMILESCCN(C(=O)C1CC(C)CCC1N)C1CCCC1
InChIInChI=1S/C15H28N2O/c1-3-17(12-6-4-5-7-12)15(18)13-10-11(2)8-9-14(13)16/h11-14H,3-10,16H2,1-2H3
InChIKeyFQOLRNVSASIEKA-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.54
Rot. Bonds3

About 2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide

2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide (PubChem CID 65455288) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide
PubChem CID65455288
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide
SMILESCCN(C(=O)C1CC(C)CCC1N)C1CCCC1
InChIInChI=1S/C15H28N2O/c1-3-17(12-6-4-5-7-12)15(18)13-10-11(2)8-9-14(13)16/h11-14H,3-10,16H2,1-2H3
InChIKeyFQOLRNVSASIEKA-UHFFFAOYSA-N
XLogP2.54
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide (CID 65455288) is 2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide is CCN(C(=O)C1CC(C)CCC1N)C1CCCC1.
What is the InChIKey of 2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide?
The InChIKey is FQOLRNVSASIEKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-3-17(12-6-4-5-7-12)15(18)13-10-11(2)8-9-14(13)16/h11-14H,3-10,16H2,1-2H3.
What are the key properties of 2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide?
2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide has a molecular weight of 252.40 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclopentyl-N-ethyl-5-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 65455288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).