3-hydroxy-N-(2-methylbutan-2-yl)butanamide

C9H19NO2 — CID 87908743

IUPAC3-hydroxy-N-(2-methylbutan-2-yl)butanamide
SMILESCCC(C)(C)NC(=O)CC(C)O
InChIInChI=1S/C9H19NO2/c1-5-9(3,4)10-8(12)6-7(2)11/h7,11H,5-6H2,1-4H3,(H,10,12)
InChIKeyAIGFDHJOOLHUFT-UHFFFAOYSA-N
MW173.26 g/mol
LogP1.06
Rot. Bonds4

About 3-hydroxy-N-(2-methylbutan-2-yl)butanamide

3-hydroxy-N-(2-methylbutan-2-yl)butanamide (PubChem CID 87908743) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 3-hydroxy-N-(2-methylbutan-2-yl)butanamide.

Molecular Properties

Compound Name3-hydroxy-N-(2-methylbutan-2-yl)butanamide
PubChem CID87908743
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name3-hydroxy-N-(2-methylbutan-2-yl)butanamide
SMILESCCC(C)(C)NC(=O)CC(C)O
InChIInChI=1S/C9H19NO2/c1-5-9(3,4)10-8(12)6-7(2)11/h7,11H,5-6H2,1-4H3,(H,10,12)
InChIKeyAIGFDHJOOLHUFT-UHFFFAOYSA-N
XLogP1.06
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methylbutan-2-yl)-2-(3-methylpentan-2-ylamino)acetamide
CID 61486133
2-hydroxy-N-(2-methylbutan-2-yl)acetamide
CID 43558880
2-(3-hydroxybutan-2-ylsulfanyl)-N-(2-methylbutan-2-yl)acetamide
CID 103705755
3-(2-methylbutan-2-ylamino)-3-oxopropanoic acid
CID 62230049
3-methyl-N-(2,4,4-trimethylpentan-2-yl)butanamide
CID 17381763
N-(2-methylbutan-2-yl)-3,3-diphenylpropanamide
CID 1292106
2-(2,3-dihydroxypropylamino)-N-(2-methylbutan-2-yl)acetamide
CID 66168467
3-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]sulfinylbutanoic acid
CID 66115959
2-[1-(dimethylamino)propan-2-ylamino]-N-(2-methylbutan-2-yl)acetamide
CID 82938261
2-(2,2-dimethylhydrazinyl)-N-(2-methylbutan-2-yl)acetamide
CID 83015090
(3R)-3-(2-methylbutan-2-ylcarbamoylamino)-N-propan-2-ylbutanamide
CID 97095456
N-(2,2-dimethylpropyl)-3-hydroxybutanamide
CID 87908757

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(2-methylbutan-2-yl)butanamide?
The IUPAC name of 3-hydroxy-N-(2-methylbutan-2-yl)butanamide (CID 87908743) is 3-hydroxy-N-(2-methylbutan-2-yl)butanamide.
What is the SMILES notation for 3-hydroxy-N-(2-methylbutan-2-yl)butanamide?
The canonical SMILES for 3-hydroxy-N-(2-methylbutan-2-yl)butanamide is CCC(C)(C)NC(=O)CC(C)O.
What is the InChIKey of 3-hydroxy-N-(2-methylbutan-2-yl)butanamide?
The InChIKey is AIGFDHJOOLHUFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-5-9(3,4)10-8(12)6-7(2)11/h7,11H,5-6H2,1-4H3,(H,10,12).
What are the key properties of 3-hydroxy-N-(2-methylbutan-2-yl)butanamide?
3-hydroxy-N-(2-methylbutan-2-yl)butanamide has a molecular weight of 173.26 g/mol, XLogP of 1.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(2-methylbutan-2-yl)butanamide is sourced from PubChem (CID 87908743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).