N-(5-hydroxy-2,2-dimethylpentyl)acetamide

C9H19NO2 — CID 103899391

IUPACN-(5-hydroxy-2,2-dimethylpentyl)acetamide
SMILESCC(=O)NCC(C)(C)CCCO
InChIInChI=1S/C9H19NO2/c1-8(12)10-7-9(2,3)5-4-6-11/h11H,4-7H2,1-3H3,(H,10,12)
InChIKeyZGTMPQIIUHRZSM-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.92
Rot. Bonds5

About N-(5-hydroxy-2,2-dimethylpentyl)acetamide

N-(5-hydroxy-2,2-dimethylpentyl)acetamide (PubChem CID 103899391) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is N-(5-hydroxy-2,2-dimethylpentyl)acetamide.

Molecular Properties

Compound NameN-(5-hydroxy-2,2-dimethylpentyl)acetamide
PubChem CID103899391
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC NameN-(5-hydroxy-2,2-dimethylpentyl)acetamide
SMILESCC(=O)NCC(C)(C)CCCO
InChIInChI=1S/C9H19NO2/c1-8(12)10-7-9(2,3)5-4-6-11/h11H,4-7H2,1-3H3,(H,10,12)
InChIKeyZGTMPQIIUHRZSM-UHFFFAOYSA-N
XLogP0.92
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(5-hydroxy-2,2-dimethylpentyl)acetamide 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

N-(5-Hydroxypentyl)acetamide
CID 12914604
N-(3-hydroxy-4,4-dimethylpentyl)pivalamide
CID 71787568
N-(5-hydroxypentyl)butanamide
CID 15732298
2,2,2-trifluoro-N-(5-hydroxy-2-methylpentyl)acetamide
CID 87580737
N-[5,5,5-trifluoro-4-(hydroxymethyl)pentyl]acetamide
CID 88125185
4,4,4-trifluoro-N-(5-hydroxy-4-methylpentyl)butanamide
CID 103862001
3,3,3-trifluoro-N-(5-hydroxy-4-methylpentyl)propanamide
CID 103862031
2,2,2-trifluoro-N-(5-hydroxy-4-methylpentyl)acetamide
CID 103862042
4,4,4-trifluoro-N-(5-hydroxy-2,2-dimethylpentyl)butanamide
CID 103899394
3,3,3-trifluoro-N-(5-hydroxy-2,2-dimethylpentyl)propanamide
CID 103899402
2,2,2-trifluoro-N-(5-hydroxy-2,2-dimethylpentyl)acetamide
CID 103899670
2,2,3,3-tetrafluoro-N-(5-hydroxy-2,2-dimethylpentyl)propanamide
CID 103900103

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxy-2,2-dimethylpentyl)acetamide?
The IUPAC name of N-(5-hydroxy-2,2-dimethylpentyl)acetamide (CID 103899391) is N-(5-hydroxy-2,2-dimethylpentyl)acetamide.
What is the SMILES notation for N-(5-hydroxy-2,2-dimethylpentyl)acetamide?
The canonical SMILES for N-(5-hydroxy-2,2-dimethylpentyl)acetamide is CC(=O)NCC(C)(C)CCCO.
What is the InChIKey of N-(5-hydroxy-2,2-dimethylpentyl)acetamide?
The InChIKey is ZGTMPQIIUHRZSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-8(12)10-7-9(2,3)5-4-6-11/h11H,4-7H2,1-3H3,(H,10,12).
What are the key properties of N-(5-hydroxy-2,2-dimethylpentyl)acetamide?
N-(5-hydroxy-2,2-dimethylpentyl)acetamide has a molecular weight of 173.26 g/mol, XLogP of 0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-hydroxy-2,2-dimethylpentyl)acetamide is sourced from PubChem (CID 103899391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).