2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide

C11H22N2O2 — CID 115140342

IUPAC2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide
SMILESCN1CCC(C(C)(C)CNC(=O)CO)C1
InChIInChI=1S/C11H22N2O2/c1-11(2,8-12-10(15)7-14)9-4-5-13(3)6-9/h9,14H,4-8H2,1-3H3,(H,12,15)
InChIKeyFJBDCTWHUXNLJB-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.07
Rot. Bonds4

About 2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide

2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide (PubChem CID 115140342) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide.

Molecular Properties

Compound Name2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide
PubChem CID115140342
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide
SMILESCN1CCC(C(C)(C)CNC(=O)CO)C1
InChIInChI=1S/C11H22N2O2/c1-11(2,8-12-10(15)7-14)9-4-5-13(3)6-9/h9,14H,4-8H2,1-3H3,(H,12,15)
InChIKeyFJBDCTWHUXNLJB-UHFFFAOYSA-N
XLogP0.07
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide?
The IUPAC name of 2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide (CID 115140342) is 2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide.
What is the SMILES notation for 2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide?
The canonical SMILES for 2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide is CN1CCC(C(C)(C)CNC(=O)CO)C1.
What is the InChIKey of 2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide?
The InChIKey is FJBDCTWHUXNLJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-11(2,8-12-10(15)7-14)9-4-5-13(3)6-9/h9,14H,4-8H2,1-3H3,(H,12,15).
What are the key properties of 2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide?
2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide has a molecular weight of 214.31 g/mol, XLogP of 0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[2-methyl-2-(1-methylpyrrolidin-3-yl)propyl]acetamide is sourced from PubChem (CID 115140342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).