2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide

C11H22N2O — CID 64921195

IUPAC2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide
SMILESCCC1CCC(NCC(=O)NC)C1C
InChIInChI=1S/C11H22N2O/c1-4-9-5-6-10(8(9)2)13-7-11(14)12-3/h8-10,13H,4-7H2,1-3H3,(H,12,14)
InChIKeyNLHASSIMBYQIMI-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.15
Rot. Bonds4

About 2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide

2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide (PubChem CID 64921195) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide.

Molecular Properties

Compound Name2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide
PubChem CID64921195
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide
SMILESCCC1CCC(NCC(=O)NC)C1C
InChIInChI=1S/C11H22N2O/c1-4-9-5-6-10(8(9)2)13-7-11(14)12-3/h8-10,13H,4-7H2,1-3H3,(H,12,14)
InChIKeyNLHASSIMBYQIMI-UHFFFAOYSA-N
XLogP1.15
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide?
The IUPAC name of 2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide (CID 64921195) is 2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide.
What is the SMILES notation for 2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide?
The canonical SMILES for 2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide is CCC1CCC(NCC(=O)NC)C1C.
What is the InChIKey of 2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide?
The InChIKey is NLHASSIMBYQIMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-4-9-5-6-10(8(9)2)13-7-11(14)12-3/h8-10,13H,4-7H2,1-3H3,(H,12,14).
What are the key properties of 2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide?
2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide has a molecular weight of 198.31 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethyl-2-methylcyclopentyl)amino]-N-methylacetamide is sourced from PubChem (CID 64921195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).