2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide

C13H26N2O2 — CID 62015445

IUPAC2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide
SMILESCCN(CC)C(=O)CN(CCO)C1CCCC1
InChIInChI=1S/C13H26N2O2/c1-3-14(4-2)13(17)11-15(9-10-16)12-7-5-6-8-12/h12,16H,3-11H2,1-2H3
InChIKeyFLWWSZQQYFWFRT-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.09
Rot. Bonds7

About 2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide

2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide (PubChem CID 62015445) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide.

Molecular Properties

Compound Name2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide
PubChem CID62015445
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide
SMILESCCN(CC)C(=O)CN(CCO)C1CCCC1
InChIInChI=1S/C13H26N2O2/c1-3-14(4-2)13(17)11-15(9-10-16)12-7-5-6-8-12/h12,16H,3-11H2,1-2H3
InChIKeyFLWWSZQQYFWFRT-UHFFFAOYSA-N
XLogP1.09
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide?
The IUPAC name of 2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide (CID 62015445) is 2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide.
What is the SMILES notation for 2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide?
The canonical SMILES for 2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide is CCN(CC)C(=O)CN(CCO)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide?
The InChIKey is FLWWSZQQYFWFRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-3-14(4-2)13(17)11-15(9-10-16)12-7-5-6-8-12/h12,16H,3-11H2,1-2H3.
What are the key properties of 2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide?
2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide has a molecular weight of 242.36 g/mol, XLogP of 1.09, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(2-hydroxyethyl)amino]-N,N-diethylacetamide is sourced from PubChem (CID 62015445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).