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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Related Compounds

2-[(3-aminocyclohexyl)-ethylamino]-N-propan-2-ylacetamide
CID 79468061
2-[azepan-4-yl(ethyl)amino]-N-propan-2-ylacetamide
CID 103983310
2-[ethyl-(4-hydroxypyrrolidin-3-yl)amino]-N-propan-2-ylacetamide
CID 63701851
2-[bis(2-hydroxyethyl)amino]cyclohexan-1-one
CID 62052223
2-[2-(dimethylamino)ethyl-(2-methylpropyl)amino]cyclohexan-1-one
CID 55010795
2-[cyclopropyl(ethyl)amino]cycloheptan-1-one
CID 60862924
2-[3-aminopropyl(cyclopentyl)amino]-N-propan-2-ylacetamide
CID 43137564
[methyl-(2-oxocyclohexyl)carbamoyl]oxymethyl 2-(2-methylpropanoylamino)propanoate
CID 139320769
N-butan-2-yl-2-[methyl-(4-oxocyclohexyl)amino]acetamide
CID 79120506
2-[benzyl(3-methylbutyl)amino]cyclohexan-1-one
CID 166083528
2-[2,3-dihydro-1H-inden-1-yl(2-hydroxyethyl)amino]-N-propan-2-ylacetamide
CID 111333591
[methyl-(2-oxocyclohexyl)carbamoyl]oxymethyl 3-methyl-2-(methylamino)butanoate
CID 139320706

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).