N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide

C11H19NO3 — CID 70799970

IUPACN-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide
SMILESCC(C)C(=O)C(C1CC1)N(C)C(=O)CO
InChIInChI=1S/C11H19NO3/c1-7(2)11(15)10(8-4-5-8)12(3)9(14)6-13/h7-8,10,13H,4-6H2,1-3H3
InChIKeyBWWVXARXGNGJLO-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.44
Rot. Bonds5

About N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide

N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide (PubChem CID 70799970) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide.

Molecular Properties

Compound NameN-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide
PubChem CID70799970
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC NameN-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide
SMILESCC(C)C(=O)C(C1CC1)N(C)C(=O)CO
InChIInChI=1S/C11H19NO3/c1-7(2)11(15)10(8-4-5-8)12(3)9(14)6-13/h7-8,10,13H,4-6H2,1-3H3
InChIKeyBWWVXARXGNGJLO-UHFFFAOYSA-N
XLogP0.44
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide 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 N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide?
The IUPAC name of N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide (CID 70799970) is N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide.
What is the SMILES notation for N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide?
The canonical SMILES for N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide is CC(C)C(=O)C(C1CC1)N(C)C(=O)CO.
What is the InChIKey of N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide?
The InChIKey is BWWVXARXGNGJLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-7(2)11(15)10(8-4-5-8)12(3)9(14)6-13/h7-8,10,13H,4-6H2,1-3H3.
What are the key properties of N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide?
N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide has a molecular weight of 213.28 g/mol, XLogP of 0.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropyl-3-methyl-2-oxobutyl)-2-hydroxy-N-methylacetamide is sourced from PubChem (CID 70799970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).