N-[(2R)-butan-2-yl]-2-methylbutanamide

C9H19NO — CID 88542995

IUPACN-[(2R)-butan-2-yl]-2-methylbutanamide
SMILESCCC(C)C(=O)N[C@H](C)CC
InChIInChI=1S/C9H19NO/c1-5-7(3)9(11)10-8(4)6-2/h7-8H,5-6H2,1-4H3,(H,10,11)/t7?,8-/m1/s1
InChIKeyAJUKUFNGHUIHRW-BRFYHDHCSA-N
MW157.26 g/mol
LogP1.95
Rot. Bonds4

About N-[(2R)-butan-2-yl]-2-methylbutanamide

N-[(2R)-butan-2-yl]-2-methylbutanamide (PubChem CID 88542995) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N-[(2R)-butan-2-yl]-2-methylbutanamide.

Molecular Properties

Compound NameN-[(2R)-butan-2-yl]-2-methylbutanamide
PubChem CID88542995
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN-[(2R)-butan-2-yl]-2-methylbutanamide
SMILESCCC(C)C(=O)N[C@H](C)CC
InChIInChI=1S/C9H19NO/c1-5-7(3)9(11)10-8(4)6-2/h7-8H,5-6H2,1-4H3,(H,10,11)/t7?,8-/m1/s1
InChIKeyAJUKUFNGHUIHRW-BRFYHDHCSA-N
XLogP1.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(2R)-butan-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

(2R)-N-[(2S)-butan-2-yl]-2-chloropropanamide
CID 14711535
5-amino-N-butan-2-yl-2-methylpentanamide
CID 112515136
(2S)-N-butan-2-yl-2-(methylamino)propanamide
CID 130563801
N-butan-2-yl-2-methyl-5-propan-2-yloxyhexanamide
CID 146303110
N-butan-2-yl-2-propylpentanamide
CID 115532227
2-(2-methylbutanoylamino)propanoic acid
CID 14758658
2-acetamido-N-butan-2-yl-3-sulfanylpropanamide
CID 88881098
N-[(2S)-butan-2-yl]-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 7039939
N-butan-2-yl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 2748455
(2R,3R)-2-amino-N-[(2S)-butan-2-yl]-3-methylpentanamide
CID 93001596
N-butan-2-ylcarbamoyl iodide
CID 118554163
N-butan-2-yl-2-(2-methylpropylamino)propanamide
CID 43113054

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-butan-2-yl]-2-methylbutanamide?
The IUPAC name of N-[(2R)-butan-2-yl]-2-methylbutanamide (CID 88542995) is N-[(2R)-butan-2-yl]-2-methylbutanamide.
What is the SMILES notation for N-[(2R)-butan-2-yl]-2-methylbutanamide?
The canonical SMILES for N-[(2R)-butan-2-yl]-2-methylbutanamide is CCC(C)C(=O)N[C@H](C)CC.
What is the InChIKey of N-[(2R)-butan-2-yl]-2-methylbutanamide?
The InChIKey is AJUKUFNGHUIHRW-BRFYHDHCSA-N. The full InChI is InChI=1S/C9H19NO/c1-5-7(3)9(11)10-8(4)6-2/h7-8H,5-6H2,1-4H3,(H,10,11)/t7?,8-/m1/s1.
What are the key properties of N-[(2R)-butan-2-yl]-2-methylbutanamide?
N-[(2R)-butan-2-yl]-2-methylbutanamide has a molecular weight of 157.26 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-butan-2-yl]-2-methylbutanamide is sourced from PubChem (CID 88542995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).