(2R)-2-(15N)azanyl-3-methylbutanoic acid

C5H11NO2 — CID 10558606

IUPAC(2R)-2-(15N)azanyl-3-methylbutanoic acid
SMILESCC(C)[C@@H]([15NH2])C(=O)O
InChIInChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m1/s1/i6+1
InChIKeyKZSNJWFQEVHDMF-HIWDATITSA-N
MW118.14 g/mol
LogP0.05
Rot. Bonds2

About (2R)-2-(15N)azanyl-3-methylbutanoic acid

(2R)-2-(15N)azanyl-3-methylbutanoic acid (PubChem CID 10558606) has the molecular formula C5H11NO2 and a molecular weight of 118.14 g/mol. Its IUPAC name is (2R)-2-(15N)azanyl-3-methylbutanoic acid.

Molecular Properties

Compound Name(2R)-2-(15N)azanyl-3-methylbutanoic acid
PubChem CID10558606
Molecular FormulaC5H11NO2
Molecular Weight118.14 g/mol
Exact Mass118.08
IUPAC Name(2R)-2-(15N)azanyl-3-methylbutanoic acid
SMILESCC(C)[C@@H]([15NH2])C(=O)O
InChIInChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m1/s1/i6+1
InChIKeyKZSNJWFQEVHDMF-HIWDATITSA-N
XLogP0.05
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.14
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-3-methylbutanoic acid;vanadium
CID 175123177
tris((2S)-2-amino-3-methylbutanoic acid);chromium
CID 156700513
silver 2-amino-3-methylbutanoic acid
CID 19021116
bis((2S)-2-amino-3-methylbutanoic acid);sulfane
CID 87598201
2-amino-3-methylbutanoic acid;zinc;dihydrate
CID 175445851
magnesium;(2S)-2-amino-3-methylbutanoic acid;dichloride
CID 159678853
(2S)-2-amino-3-methylbutanoic acid;silyloxysilane
CID 173116914
(2S)-2-amino-3-methylbutanoic acid;carbonyl dichloride
CID 87642721
(2S)-2-amino-3-methylbutanamide;(2S)-2-amino-3-methylbutanoic acid
CID 175839028
(2S)-2-amino-3-methylbutanoic acid;benzene;chloromethane
CID 159269253
(2S)-2-amino-3-methylbutanoic acid;formic acid
CID 160949818
2-amino-3-hydroxybutanoic acid;(2S)-2-amino-3-methylbutanoic acid
CID 146265314

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(15N)azanyl-3-methylbutanoic acid?
The IUPAC name of (2R)-2-(15N)azanyl-3-methylbutanoic acid (CID 10558606) is (2R)-2-(15N)azanyl-3-methylbutanoic acid.
What is the SMILES notation for (2R)-2-(15N)azanyl-3-methylbutanoic acid?
The canonical SMILES for (2R)-2-(15N)azanyl-3-methylbutanoic acid is CC(C)[C@@H]([15NH2])C(=O)O.
What is the InChIKey of (2R)-2-(15N)azanyl-3-methylbutanoic acid?
The InChIKey is KZSNJWFQEVHDMF-HIWDATITSA-N. The full InChI is InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m1/s1/i6+1.
What are the key properties of (2R)-2-(15N)azanyl-3-methylbutanoic acid?
(2R)-2-(15N)azanyl-3-methylbutanoic acid has a molecular weight of 118.14 g/mol, XLogP of 0.05, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(15N)azanyl-3-methylbutanoic acid is sourced from PubChem (CID 10558606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).