2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide

C10H21NO2 — CID 104936584

IUPAC2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide
SMILESCC(C)CCCNC(=O)C(C)(C)O
InChIInChI=1S/C10H21NO2/c1-8(2)6-5-7-11-9(12)10(3,4)13/h8,13H,5-7H2,1-4H3,(H,11,12)
InChIKeyYVRONLGLVCUVBH-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.31
Rot. Bonds5

About 2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide

2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide (PubChem CID 104936584) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide.

Molecular Properties

Compound Name2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide
PubChem CID104936584
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide
SMILESCC(C)CCCNC(=O)C(C)(C)O
InChIInChI=1S/C10H21NO2/c1-8(2)6-5-7-11-9(12)10(3,4)13/h8,13H,5-7H2,1-4H3,(H,11,12)
InChIKeyYVRONLGLVCUVBH-UHFFFAOYSA-N
XLogP1.31
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-hydroxy-2-methyl-N-(5-methylhexyl)propanamide
CID 103430276
2-hydroxy-2-methyl-N-(3-methylbutyl)propanamide
CID 104936395
2-hydroxy-2-methyl-N-[3-(2-methylpropoxy)propyl]propanamide
CID 104936506
3-amino-2,2,3-trimethyl-N-(7-methyloctyl)butanamide
CID 65269830
2-cyano-2-methyl-N-(4-methylpentyl)butanamide
CID 114291478
2,2,2-trifluoro-N-(7-methyloctyl)acetamide
CID 62491646
(2R)-2-amino-3,3-dimethyl-N-(4-methylpentyl)butanamide
CID 103929431
3,3,3-trifluoro-2,2-dimethyl-N-(11-methyldodecyl)propanamide
CID 170026598
2-hydroxy-N-(2-hydroxyethyl)-2-methylpropanamide
CID 21330073
N-(4-methylpentyl)propanamide
CID 54140551
N-butyl-2,2,5-trimethylhexanamide
CID 145422242
3-(tert-butylamino)-N-(4-methylpentyl)propanamide
CID 61044511

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide?
The IUPAC name of 2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide (CID 104936584) is 2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide.
What is the SMILES notation for 2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide?
The canonical SMILES for 2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide is CC(C)CCCNC(=O)C(C)(C)O.
What is the InChIKey of 2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide?
The InChIKey is YVRONLGLVCUVBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-8(2)6-5-7-11-9(12)10(3,4)13/h8,13H,5-7H2,1-4H3,(H,11,12).
What are the key properties of 2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide?
2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide has a molecular weight of 187.28 g/mol, XLogP of 1.31, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-N-(4-methylpentyl)propanamide is sourced from PubChem (CID 104936584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).