(2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide

C10H22N2O — CID 79024933

IUPAC(2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide
SMILESCC[C@H](N)C(=O)N(C)C(C)C(C)C
InChIInChI=1S/C10H22N2O/c1-6-9(11)10(13)12(5)8(4)7(2)3/h7-9H,6,11H2,1-5H3/t8?,9-/m0/s1
InChIKeyVOGCGTDXMWGOKJ-GKAPJAKFSA-N
MW186.30 g/mol
LogP1.23
Rot. Bonds4

About (2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide

(2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide (PubChem CID 79024933) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is (2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide
PubChem CID79024933
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name(2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide
SMILESCC[C@H](N)C(=O)N(C)C(C)C(C)C
InChIInChI=1S/C10H22N2O/c1-6-9(11)10(13)12(5)8(4)7(2)3/h7-9H,6,11H2,1-5H3/t8?,9-/m0/s1
InChIKeyVOGCGTDXMWGOKJ-GKAPJAKFSA-N
XLogP1.23
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide 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

2-amino-N,N-dimethylbutanamide
CID 43649466
(2S)-2-amino-N-methyl-N-(4-methylsulfanylbutan-2-yl)butanamide
CID 103797449
(2S)-2-amino-N-methyl-N-propylbutanamide
CID 79025089
(2S)-2-amino-N-[1-(2-hydroxyphenyl)ethyl]-N-methylbutanamide
CID 79024859
(2S)-2-[[(2S)-2-[[(2S)-2-aminobutanoyl]-methylamino]-3-methylbutanoyl]amino]butanedioic acid
CID 175750227
2-amino-N-methyl-N-(3-methylbutan-2-yl)acetamide
CID 43570257
(2S)-2-amino-N-(2-amino-2-oxoethyl)-N-methylbutanamide
CID 79025132
(2R)-2-amino-N,3-dimethyl-N-pentan-3-ylbutanamide
CID 79011778
2-amino-N-(2-amino-2-oxoethyl)-N-methylbutanamide
CID 43649583
(2S)-2-amino-N-(2-methylpropyl)-N-propan-2-ylbutanamide
CID 79024707
2-amino-N-[1-(2,4-dichlorophenyl)ethyl]-N-methylbutanamide
CID 54870634
(2R)-2-amino-N-methyl-N-(2-propan-2-yloxyethyl)butanamide
CID 81055167

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide?
The IUPAC name of (2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide (CID 79024933) is (2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide.
What is the SMILES notation for (2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide?
The canonical SMILES for (2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide is CC[C@H](N)C(=O)N(C)C(C)C(C)C.
What is the InChIKey of (2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide?
The InChIKey is VOGCGTDXMWGOKJ-GKAPJAKFSA-N. The full InChI is InChI=1S/C10H22N2O/c1-6-9(11)10(13)12(5)8(4)7(2)3/h7-9H,6,11H2,1-5H3/t8?,9-/m0/s1.
What are the key properties of (2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide?
(2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide has a molecular weight of 186.30 g/mol, XLogP of 1.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-methyl-N-(3-methylbutan-2-yl)butanamide is sourced from PubChem (CID 79024933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).