2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide

C13H24N2O2 — CID 62036694

IUPAC2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)C1CCCCC1=O
InChIInChI=1S/C13H24N2O2/c1-4-15(9-13(17)14-10(2)3)11-7-5-6-8-12(11)16/h10-11H,4-9H2,1-3H3,(H,14,17)
InChIKeyYDEWSWCHKQCZMZ-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.34
Rot. Bonds5

About 2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide

2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide (PubChem CID 62036694) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide
PubChem CID62036694
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)C1CCCCC1=O
InChIInChI=1S/C13H24N2O2/c1-4-15(9-13(17)14-10(2)3)11-7-5-6-8-12(11)16/h10-11H,4-9H2,1-3H3,(H,14,17)
InChIKeyYDEWSWCHKQCZMZ-UHFFFAOYSA-N
XLogP1.34
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide (CID 62036694) is 2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide is CCN(CC(=O)NC(C)C)C1CCCCC1=O.
What is the InChIKey of 2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide?
The InChIKey is YDEWSWCHKQCZMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-4-15(9-13(17)14-10(2)3)11-7-5-6-8-12(11)16/h10-11H,4-9H2,1-3H3,(H,14,17).
What are the key properties of 2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide?
2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide has a molecular weight of 240.35 g/mol, XLogP of 1.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(2-oxocyclohexyl)amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 62036694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).