(2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide

C15H30N2O — CID 177369571

IUPAC(2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide
SMILESCCC(CC)[C@@H](C(N)=O)N1CCC(CC)(CC)C1
InChIInChI=1S/C15H30N2O/c1-5-12(6-2)13(14(16)18)17-10-9-15(7-3,8-4)11-17/h12-13H,5-11H2,1-4H3,(H2,16,18)/t13-/m0/s1
InChIKeyAMQBLQXWWOHQOC-ZDUSSCGKSA-N
MW254.42 g/mol
LogP2.79
Rot. Bonds7

About (2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide

(2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide (PubChem CID 177369571) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is (2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide.

Molecular Properties

Compound Name(2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide
PubChem CID177369571
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name(2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide
SMILESCCC(CC)[C@@H](C(N)=O)N1CCC(CC)(CC)C1
InChIInChI=1S/C15H30N2O/c1-5-12(6-2)13(14(16)18)17-10-9-15(7-3,8-4)11-17/h12-13H,5-11H2,1-4H3,(H2,16,18)/t13-/m0/s1
InChIKeyAMQBLQXWWOHQOC-ZDUSSCGKSA-N
XLogP2.79
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide?
The IUPAC name of (2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide (CID 177369571) is (2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide.
What is the SMILES notation for (2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide?
The canonical SMILES for (2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide is CCC(CC)[C@@H](C(N)=O)N1CCC(CC)(CC)C1.
What is the InChIKey of (2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide?
The InChIKey is AMQBLQXWWOHQOC-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H30N2O/c1-5-12(6-2)13(14(16)18)17-10-9-15(7-3,8-4)11-17/h12-13H,5-11H2,1-4H3,(H2,16,18)/t13-/m0/s1.
What are the key properties of (2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide?
(2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide has a molecular weight of 254.42 g/mol, XLogP of 2.79, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(3,3-diethylpyrrolidin-1-yl)-3-ethylpentanamide is sourced from PubChem (CID 177369571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).