2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide

C14H26N2O2 — CID 62782215

IUPAC2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide
SMILESCOC1CCCC1NC(=O)C1CCCC(C)C1N
InChIInChI=1S/C14H26N2O2/c1-9-5-3-6-10(13(9)15)14(17)16-11-7-4-8-12(11)18-2/h9-13H,3-8,15H2,1-2H3,(H,16,17)
InChIKeyBBOMZPZGOKGHAR-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.43
Rot. Bonds3

About 2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide

2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide (PubChem CID 62782215) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide
PubChem CID62782215
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide
SMILESCOC1CCCC1NC(=O)C1CCCC(C)C1N
InChIInChI=1S/C14H26N2O2/c1-9-5-3-6-10(13(9)15)14(17)16-11-7-4-8-12(11)18-2/h9-13H,3-8,15H2,1-2H3,(H,16,17)
InChIKeyBBOMZPZGOKGHAR-UHFFFAOYSA-N
XLogP1.43
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide (CID 62782215) is 2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide is COC1CCCC1NC(=O)C1CCCC(C)C1N.
What is the InChIKey of 2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide?
The InChIKey is BBOMZPZGOKGHAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-9-5-3-6-10(13(9)15)14(17)16-11-7-4-8-12(11)18-2/h9-13H,3-8,15H2,1-2H3,(H,16,17).
What are the key properties of 2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide?
2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 1.43, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-methoxycyclopentyl)-3-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 62782215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).