(2S,3R)-2-amino-N-hydroxy-3-methylpentanamide

C6H14N2O2 — CID 129369774

IUPAC(2S,3R)-2-amino-N-hydroxy-3-methylpentanamide
SMILESCC[C@@H](C)[C@H](N)C(=O)NO
InChIInChI=1S/C6H14N2O2/c1-3-4(2)5(7)6(9)8-10/h4-5,10H,3,7H2,1-2H3,(H,8,9)/t4-,5+/m1/s1
InChIKeyGMKATDLSKRGLMZ-UHNVWZDZSA-N
MW146.19 g/mol
LogP-0.13
Rot. Bonds3

About (2S,3R)-2-amino-N-hydroxy-3-methylpentanamide

(2S,3R)-2-amino-N-hydroxy-3-methylpentanamide (PubChem CID 129369774) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is (2S,3R)-2-amino-N-hydroxy-3-methylpentanamide.

Molecular Properties

Compound Name(2S,3R)-2-amino-N-hydroxy-3-methylpentanamide
PubChem CID129369774
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC Name(2S,3R)-2-amino-N-hydroxy-3-methylpentanamide
SMILESCC[C@@H](C)[C@H](N)C(=O)NO
InChIInChI=1S/C6H14N2O2/c1-3-4(2)5(7)6(9)8-10/h4-5,10H,3,7H2,1-2H3,(H,8,9)/t4-,5+/m1/s1
InChIKeyGMKATDLSKRGLMZ-UHNVWZDZSA-N
XLogP-0.13
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-amino-N-ethyl-3-methylpentanamide
CID 61172974
[(2S,3S)-2-amino-3-methylpentanoyl]carbamic acid
CID 139812366
(2R,3R)-2-amino-N-[(2S)-butan-2-yl]-3-methylpentanamide
CID 93001596
(2S,3S)-2-amino-N',N',3-trimethylpentanehydrazide
CID 83021185
(2S,3S)-2-amino-N-[(2R)-2-hydroxypropyl]-3-methylpentanamide
CID 93083392
2-amino-N-cyclopropyl-3-methylpentanamide
CID 24695258
(2S,3S)-2-amino-3-methyl-N-(2-methylpentan-3-yl)pentanamide
CID 61472767
2-amino-3-methyl-N-(2-methylbutyl)pentanamide
CID 62693739
(2S)-2-amino-N-[(2R)-1-hydroxypropan-2-yl]-3-methylpentanamide
CID 107218532
N-(2-acetamidoethyl)-2-amino-3-methylpentanamide
CID 43552884
2-amino-N-(2,2-difluoroethyl)-3-methylpentanamide
CID 81489680
3-[(2-amino-3-methylpentanoyl)amino]butanoic acid
CID 61161973

Frequently Asked Questions

What is the IUPAC name of (2S,3R)-2-amino-N-hydroxy-3-methylpentanamide?
The IUPAC name of (2S,3R)-2-amino-N-hydroxy-3-methylpentanamide (CID 129369774) is (2S,3R)-2-amino-N-hydroxy-3-methylpentanamide.
What is the SMILES notation for (2S,3R)-2-amino-N-hydroxy-3-methylpentanamide?
The canonical SMILES for (2S,3R)-2-amino-N-hydroxy-3-methylpentanamide is CC[C@@H](C)[C@H](N)C(=O)NO.
What is the InChIKey of (2S,3R)-2-amino-N-hydroxy-3-methylpentanamide?
The InChIKey is GMKATDLSKRGLMZ-UHNVWZDZSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-3-4(2)5(7)6(9)8-10/h4-5,10H,3,7H2,1-2H3,(H,8,9)/t4-,5+/m1/s1.
What are the key properties of (2S,3R)-2-amino-N-hydroxy-3-methylpentanamide?
(2S,3R)-2-amino-N-hydroxy-3-methylpentanamide has a molecular weight of 146.19 g/mol, XLogP of -0.13, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R)-2-amino-N-hydroxy-3-methylpentanamide is sourced from PubChem (CID 129369774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).