2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide

C11H22N2O — CID 62783165

IUPAC2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)CC1CCC(N)CC1
InChIInChI=1S/C11H22N2O/c1-3-13(2)11(14)8-9-4-6-10(12)7-5-9/h9-10H,3-8,12H2,1-2H3
InChIKeyANCWJSPCAUUBBJ-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.37
Rot. Bonds3

About 2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide

2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide (PubChem CID 62783165) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide.

Molecular Properties

Compound Name2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide
PubChem CID62783165
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)CC1CCC(N)CC1
InChIInChI=1S/C11H22N2O/c1-3-13(2)11(14)8-9-4-6-10(12)7-5-9/h9-10H,3-8,12H2,1-2H3
InChIKeyANCWJSPCAUUBBJ-UHFFFAOYSA-N
XLogP1.37
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide?
The IUPAC name of 2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide (CID 62783165) is 2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide.
What is the SMILES notation for 2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide?
The canonical SMILES for 2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide is CCN(C)C(=O)CC1CCC(N)CC1.
What is the InChIKey of 2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide?
The InChIKey is ANCWJSPCAUUBBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-13(2)11(14)8-9-4-6-10(12)7-5-9/h9-10H,3-8,12H2,1-2H3.
What are the key properties of 2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide?
2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide has a molecular weight of 198.31 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminocyclohexyl)-N-ethyl-N-methylacetamide is sourced from PubChem (CID 62783165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).