2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide

C15H28N2O — CID 82765419

IUPAC2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide
SMILESCCN(C(=O)C1(C)CCCC1N)C1CCCCC1
InChIInChI=1S/C15H28N2O/c1-3-17(12-8-5-4-6-9-12)14(18)15(2)11-7-10-13(15)16/h12-13H,3-11,16H2,1-2H3
InChIKeyAHSZVCALWTUGRU-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.69
Rot. Bonds3

About 2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide

2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide (PubChem CID 82765419) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide
PubChem CID82765419
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide
SMILESCCN(C(=O)C1(C)CCCC1N)C1CCCCC1
InChIInChI=1S/C15H28N2O/c1-3-17(12-8-5-4-6-9-12)14(18)15(2)11-7-10-13(15)16/h12-13H,3-11,16H2,1-2H3
InChIKeyAHSZVCALWTUGRU-UHFFFAOYSA-N
XLogP2.69
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 ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide (CID 82765419) is 2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide is CCN(C(=O)C1(C)CCCC1N)C1CCCCC1.
What is the InChIKey of 2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide?
The InChIKey is AHSZVCALWTUGRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-3-17(12-8-5-4-6-9-12)14(18)15(2)11-7-10-13(15)16/h12-13H,3-11,16H2,1-2H3.
What are the key properties of 2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide?
2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide has a molecular weight of 252.40 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclohexyl-N-ethyl-1-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 82765419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).