3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide

C11H22N2O2 — CID 103728301

IUPAC3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCN1CCC(C)(O)C1
InChIInChI=1S/C11H22N2O2/c1-9(2)12-10(14)4-6-13-7-5-11(3,15)8-13/h9,15H,4-8H2,1-3H3,(H,12,14)
InChIKeyLZKGUCYVRGTRAM-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.36
Rot. Bonds4

About 3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide

3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide (PubChem CID 103728301) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide
PubChem CID103728301
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCN1CCC(C)(O)C1
InChIInChI=1S/C11H22N2O2/c1-9(2)12-10(14)4-6-13-7-5-11(3,15)8-13/h9,15H,4-8H2,1-3H3,(H,12,14)
InChIKeyLZKGUCYVRGTRAM-UHFFFAOYSA-N
XLogP0.36
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 ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-1-[3-oxo-3-(propan-2-ylamino)propyl]piperidine-4-carboxylic acid
CID 55176993
methyl 3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanoate
CID 103729366
N-ethyl-3-(3-hydroxy-3-methylpiperidin-1-yl)propanamide
CID 115874028
3-[4-[(2R)-2-hydroxypropyl]piperazin-1-yl]-N-propan-2-ylpropanamide
CID 95338932
N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide
CID 103728822
6-(3-hydroxy-3-methylpyrrolidin-1-yl)hexan-3-one
CID 106801627
N-ethyl-3-(4-hydroxy-4-methylazepan-1-yl)propanamide
CID 107408256
N-heptan-2-yl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide
CID 103728598
N-(3-carbamothioylphenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide
CID 103356209
3-[2-(3-hydroxy-3-methylpyrrolidin-1-yl)ethylsulfonyl]propanamide
CID 113249862
3-[1-[3-oxo-3-(propan-2-ylamino)propyl]piperidin-4-yl]propanoic acid
CID 62627528
4-(4-hydroxy-4-methylazepan-1-yl)butan-2-one
CID 107405316

Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide?
The IUPAC name of 3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide (CID 103728301) is 3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide is CC(C)NC(=O)CCN1CCC(C)(O)C1.
What is the InChIKey of 3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide?
The InChIKey is LZKGUCYVRGTRAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(2)12-10(14)4-6-13-7-5-11(3,15)8-13/h9,15H,4-8H2,1-3H3,(H,12,14).
What are the key properties of 3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide?
3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide has a molecular weight of 214.31 g/mol, XLogP of 0.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 103728301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).