N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide

C11H22N2O2 — CID 103728785

IUPACN,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide
SMILESCCN(CC)C(=O)CN1CCC(C)(O)C1
InChIInChI=1S/C11H22N2O2/c1-4-13(5-2)10(14)8-12-7-6-11(3,15)9-12/h15H,4-9H2,1-3H3
InChIKeyBGERSFVMDMFAIE-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.31
Rot. Bonds4

About N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide

N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide (PubChem CID 103728785) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide
PubChem CID103728785
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide
SMILESCCN(CC)C(=O)CN1CCC(C)(O)C1
InChIInChI=1S/C11H22N2O2/c1-4-13(5-2)10(14)8-12-7-6-11(3,15)9-12/h15H,4-9H2,1-3H3
InChIKeyBGERSFVMDMFAIE-UHFFFAOYSA-N
XLogP0.31
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide?
The IUPAC name of N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide (CID 103728785) is N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide.
What is the SMILES notation for N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide?
The canonical SMILES for N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide is CCN(CC)C(=O)CN1CCC(C)(O)C1.
What is the InChIKey of N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide?
The InChIKey is BGERSFVMDMFAIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-4-13(5-2)10(14)8-12-7-6-11(3,15)9-12/h15H,4-9H2,1-3H3.
What are the key properties of N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide?
N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide has a molecular weight of 214.31 g/mol, XLogP of 0.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide is sourced from PubChem (CID 103728785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).