2-amino-3-methylbutanoic acid;vanadium

C5H11NO2V — CID 175123177

IUPAC2-amino-3-methylbutanoic acid;vanadium
SMILESCC(C)C(N)C(=O)O.[V]
InChIInChI=1S/C5H11NO2.V/c1-3(2)4(6)5(7)8;/h3-4H,6H2,1-2H3,(H,7,8);
InChIKeyOUUGRSAOFWAVJV-UHFFFAOYSA-N
MW168.09 g/mol
LogP0.05
Rot. Bonds2

About 2-amino-3-methylbutanoic acid;vanadium

2-amino-3-methylbutanoic acid;vanadium (PubChem CID 175123177) has the molecular formula C5H11NO2V and a molecular weight of 168.09 g/mol. Its IUPAC name is 2-amino-3-methylbutanoic acid;vanadium.

Molecular Properties

Compound Name2-amino-3-methylbutanoic acid;vanadium
PubChem CID175123177
Molecular FormulaC5H11NO2V
Molecular Weight168.09 g/mol
Exact Mass168.02
IUPAC Name2-amino-3-methylbutanoic acid;vanadium
SMILESCC(C)C(N)C(=O)O.[V]
InChIInChI=1S/C5H11NO2.V/c1-3(2)4(6)5(7)8;/h3-4H,6H2,1-2H3,(H,7,8);
InChIKeyOUUGRSAOFWAVJV-UHFFFAOYSA-N
XLogP0.05
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.09
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methylbutanoic acid;vanadium?
The IUPAC name of 2-amino-3-methylbutanoic acid;vanadium (CID 175123177) is 2-amino-3-methylbutanoic acid;vanadium.
What is the SMILES notation for 2-amino-3-methylbutanoic acid;vanadium?
The canonical SMILES for 2-amino-3-methylbutanoic acid;vanadium is CC(C)C(N)C(=O)O.[V].
What is the InChIKey of 2-amino-3-methylbutanoic acid;vanadium?
The InChIKey is OUUGRSAOFWAVJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2.V/c1-3(2)4(6)5(7)8;/h3-4H,6H2,1-2H3,(H,7,8);.
What are the key properties of 2-amino-3-methylbutanoic acid;vanadium?
2-amino-3-methylbutanoic acid;vanadium has a molecular weight of 168.09 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 2-amino-3-methylbutanoic acid;vanadium is sourced from PubChem (CID 175123177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).