(2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide

C9H19N3O2 — CID 79013078

IUPAC(2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide
SMILESCC(C)[C@@H](N)C(=O)NC(C)(C)C(N)=O
InChIInChI=1S/C9H19N3O2/c1-5(2)6(10)7(13)12-9(3,4)8(11)14/h5-6H,10H2,1-4H3,(H2,11,14)(H,12,13)/t6-/m1/s1
InChIKeyVEUTUBNVLCCXPA-ZCFIWIBFSA-N
MW201.27 g/mol
LogP-0.65
Rot. Bonds4

About (2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide

(2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide (PubChem CID 79013078) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is (2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide
PubChem CID79013078
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC Name(2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide
SMILESCC(C)[C@@H](N)C(=O)NC(C)(C)C(N)=O
InChIInChI=1S/C9H19N3O2/c1-5(2)6(10)7(13)12-9(3,4)8(11)14/h5-6H,10H2,1-4H3,(H2,11,14)(H,12,13)/t6-/m1/s1
InChIKeyVEUTUBNVLCCXPA-ZCFIWIBFSA-N
XLogP-0.65
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide with MolForge

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Related Compounds

methyl 2-[[(2R)-2-amino-3-methylbutanoyl]amino]-2-methylpropanoate
CID 79011701
(2S)-2-amino-3-methyl-N-(3-methylpentan-3-yl)butanamide
CID 106328618
tert-butyl 2-[[2-[[2-[[2-[[(2S)-2-amino-3-methylbutanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoate
CID 10649464
N-(1-amino-2-methyl-1-oxopropan-2-yl)-2,4-dimethylpentanamide
CID 163254959
2-amino-N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-3-methylbutanamide
CID 107852750
2-[(2-amino-3-methoxypropanoyl)amino]-2-methylpropanamide
CID 81089472
(2S)-2-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-3-methylbutanamide;hydrochloride
CID 119296292
(2S)-2-amino-N-(1-hydroxy-2-methylbutan-2-yl)-3-methylbutanamide
CID 64549101
(2S,3R)-2-amino-N-tert-butyl-3-hydroxybutanamide
CID 164800238
(2R)-2-amino-N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylbutanamide
CID 105058270
N-(1-amino-2-methyl-1-oxopropan-2-yl)-4-methylpentanamide
CID 130214691
3-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-2,2,3-trimethylbutanamide
CID 65269732

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide?
The IUPAC name of (2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide (CID 79013078) is (2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide.
What is the SMILES notation for (2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide?
The canonical SMILES for (2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide is CC(C)[C@@H](N)C(=O)NC(C)(C)C(N)=O.
What is the InChIKey of (2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide?
The InChIKey is VEUTUBNVLCCXPA-ZCFIWIBFSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-5(2)6(10)7(13)12-9(3,4)8(11)14/h5-6H,10H2,1-4H3,(H2,11,14)(H,12,13)/t6-/m1/s1.
What are the key properties of (2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide?
(2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide has a molecular weight of 201.27 g/mol, XLogP of -0.65, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-methylbutanamide is sourced from PubChem (CID 79013078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).