2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide

C13H25NO — CID 123845795

IUPAC2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide
SMILESCCN(CC)C(=O)CC1CCC(C)(C)C1
InChIInChI=1S/C13H25NO/c1-5-14(6-2)12(15)9-11-7-8-13(3,4)10-11/h11H,5-10H2,1-4H3
InChIKeySKDGYWAAUHSHCD-UHFFFAOYSA-N
MW211.35 g/mol
LogP3.07
Rot. Bonds4

About 2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide

2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide (PubChem CID 123845795) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide.

Molecular Properties

Compound Name2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide
PubChem CID123845795
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide
SMILESCCN(CC)C(=O)CC1CCC(C)(C)C1
InChIInChI=1S/C13H25NO/c1-5-14(6-2)12(15)9-11-7-8-13(3,4)10-11/h11H,5-10H2,1-4H3
InChIKeySKDGYWAAUHSHCD-UHFFFAOYSA-N
XLogP3.07
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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N,N-Diethyl-2-methyloctanamide
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Cyclopentaneacetamide, N,N-diethyl-
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2-(3-tert-butylcyclopentyl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
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N,N-diethyl-3,5,5-trimethylhexanamide
CID 88772033

Frequently Asked Questions

What is the IUPAC name of 2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide?
The IUPAC name of 2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide (CID 123845795) is 2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide.
What is the SMILES notation for 2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide?
The canonical SMILES for 2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide is CCN(CC)C(=O)CC1CCC(C)(C)C1.
What is the InChIKey of 2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide?
The InChIKey is SKDGYWAAUHSHCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-5-14(6-2)12(15)9-11-7-8-13(3,4)10-11/h11H,5-10H2,1-4H3.
What are the key properties of 2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide?
2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide has a molecular weight of 211.35 g/mol, XLogP of 3.07, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-dimethylcyclopentyl)-N,N-diethylacetamide is sourced from PubChem (CID 123845795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).