N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide

C9H19NO2 — CID 103919845

IUPACN-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide
SMILESCCC(C)C(=O)N[C@H](CC)CO
InChIInChI=1S/C9H19NO2/c1-4-7(3)9(12)10-8(5-2)6-11/h7-8,11H,4-6H2,1-3H3,(H,10,12)/t7?,8-/m1/s1
InChIKeyUNQYNZMEUUYRQS-BRFYHDHCSA-N
MW173.26 g/mol
LogP0.92
Rot. Bonds5

About N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide

N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide (PubChem CID 103919845) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide.

Molecular Properties

Compound NameN-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide
PubChem CID103919845
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC NameN-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide
SMILESCCC(C)C(=O)N[C@H](CC)CO
InChIInChI=1S/C9H19NO2/c1-4-7(3)9(12)10-8(5-2)6-11/h7-8,11H,4-6H2,1-3H3,(H,10,12)/t7?,8-/m1/s1
InChIKeyUNQYNZMEUUYRQS-BRFYHDHCSA-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-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide 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

3-amino-N-(1-hydroxybutan-2-yl)-2-methylpropanamide
CID 62668866
N-(1,4-dihydroxybutan-2-yl)-2-methylbutanamide
CID 59861010
6-amino-N-[(2R)-1-hydroxybutan-2-yl]-2-methylheptanamide
CID 107221399
2-(2-methylbutanoylamino)propanoic acid
CID 14758658
(2S)-2-amino-N-[(2S)-1-hydroxybutan-2-yl]-3-methylpentanamide
CID 107222401
2-(carbamoylamino)-N-[(2R)-1-hydroxybutan-2-yl]-4-methylpentanamide
CID 113498876
2-(carbamoylamino)-N-(1-hydroxybutan-2-yl)-4-methylpentanamide
CID 43428008
2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide
CID 43500021
2-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)butanamide
CID 61246170
3-amino-4-[[(2S)-1-hydroxybutan-2-yl]amino]-4-oxobutanoic acid
CID 107222531
N-(1,3-dihydroxypropan-2-yl)-2-methylhexanamide
CID 154697432
S-[2-(2-methylbutanoylamino)butyl] ethanethioate
CID 22091047

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide?
The IUPAC name of N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide (CID 103919845) is N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide.
What is the SMILES notation for N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide?
The canonical SMILES for N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide is CCC(C)C(=O)N[C@H](CC)CO.
What is the InChIKey of N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide?
The InChIKey is UNQYNZMEUUYRQS-BRFYHDHCSA-N. The full InChI is InChI=1S/C9H19NO2/c1-4-7(3)9(12)10-8(5-2)6-11/h7-8,11H,4-6H2,1-3H3,(H,10,12)/t7?,8-/m1/s1.
What are the key properties of N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide?
N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide 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-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide is sourced from PubChem (CID 103919845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).