3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide

C11H24N2O3 — CID 106113085

IUPAC3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide
SMILESCOC(CN)C(=O)NCC(C)(O)CC(C)C
InChIInChI=1S/C11H24N2O3/c1-8(2)5-11(3,15)7-13-10(14)9(6-12)16-4/h8-9,15H,5-7,12H2,1-4H3,(H,13,14)
InChIKeyBJGXQDSQIKIOKC-UHFFFAOYSA-N
MW232.32 g/mol
LogP-0.13
Rot. Bonds7

About 3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide

3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide (PubChem CID 106113085) has the molecular formula C11H24N2O3 and a molecular weight of 232.32 g/mol. Its IUPAC name is 3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide.

Molecular Properties

Compound Name3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide
PubChem CID106113085
Molecular FormulaC11H24N2O3
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide
SMILESCOC(CN)C(=O)NCC(C)(O)CC(C)C
InChIInChI=1S/C11H24N2O3/c1-8(2)5-11(3,15)7-13-10(14)9(6-12)16-4/h8-9,15H,5-7,12H2,1-4H3,(H,13,14)
InChIKeyBJGXQDSQIKIOKC-UHFFFAOYSA-N
XLogP-0.13
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide 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 3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide?
The IUPAC name of 3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide (CID 106113085) is 3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide.
What is the SMILES notation for 3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide?
The canonical SMILES for 3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide is COC(CN)C(=O)NCC(C)(O)CC(C)C.
What is the InChIKey of 3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide?
The InChIKey is BJGXQDSQIKIOKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3/c1-8(2)5-11(3,15)7-13-10(14)9(6-12)16-4/h8-9,15H,5-7,12H2,1-4H3,(H,13,14).
What are the key properties of 3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide?
3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide has a molecular weight of 232.32 g/mol, XLogP of -0.13, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-hydroxy-2,4-dimethylpentyl)-2-methoxypropanamide is sourced from PubChem (CID 106113085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).