N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide

C11H23NO2 — CID 71916902

IUPACN-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide
SMILESCC(C)C(O)CNC(=O)CC(C)(C)C
InChIInChI=1S/C11H23NO2/c1-8(2)9(13)7-12-10(14)6-11(3,4)5/h8-9,13H,6-7H2,1-5H3,(H,12,14)
InChIKeyLFSMVGLFOYFMCN-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.56
Rot. Bonds4

About N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide

N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide (PubChem CID 71916902) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide
PubChem CID71916902
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC NameN-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide
SMILESCC(C)C(O)CNC(=O)CC(C)(C)C
InChIInChI=1S/C11H23NO2/c1-8(2)9(13)7-12-10(14)6-11(3,4)5/h8-9,13H,6-7H2,1-5H3,(H,12,14)
InChIKeyLFSMVGLFOYFMCN-UHFFFAOYSA-N
XLogP1.56
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide 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

Dexpanthenol
CID 131204
DL-panthenol
CID 4678
Panthenol, (S)-
CID 5748487
N-(2-Hydroxyethyl)-2,3-dimethyl-2-isopropylbutanamide
CID 22182807
(2R)-2,4-dihydroxy-3,3-dimethyl-N-[4-(3-methylbutylamino)-4-oxobutyl]butanamide
CID 25172809
N-(2-hydroxypropyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 11424187
(2R)-2,4-dihydroxy-3,3-dimethyl-N-[4-(2-methylpropylamino)-4-oxobutyl]butanamide
CID 25172807
N-[(2S)-1,3-Dihydroxybutan-2-yl]-3-methylbutanamide
CID 44421758
Xylariamide
CID 102222778
N-(3-hydroxy-4,4-dimethylpentyl)cyclopropanecarboxamide
CID 71787566
N-(3-hydroxy-4,4-dimethylpentyl)cyclobutanecarboxamide
CID 71787567
N-(3-hydroxy-4,4-dimethylpentyl)pivalamide
CID 71787568

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide?
The IUPAC name of N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide (CID 71916902) is N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide.
What is the SMILES notation for N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide?
The canonical SMILES for N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide is CC(C)C(O)CNC(=O)CC(C)(C)C.
What is the InChIKey of N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide?
The InChIKey is LFSMVGLFOYFMCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-8(2)9(13)7-12-10(14)6-11(3,4)5/h8-9,13H,6-7H2,1-5H3,(H,12,14).
What are the key properties of N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide?
N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide has a molecular weight of 201.31 g/mol, XLogP of 1.56, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-methylbutyl)-3,3-dimethylbutanamide is sourced from PubChem (CID 71916902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).