bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium

C6H12N4O5V — CID 59391475

IUPACbis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium
SMILESNC(=O)/C=C(/N)O.NC(=O)/C=C(/N)O.O=[V]
InChIInChI=1S/2C3H6N2O2.O.V/c2*4-2(6)1-3(5)7;;/h2*1,6H,4H2,(H2,5,7);;/b2*2-1-;;
InChIKeyOLJPDFZOKPCDCY-SUXDNRKISA-N
MW271.13 g/mol
LogP-2.46
Rot. Bonds2

About bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium

bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium (PubChem CID 59391475) has the molecular formula C6H12N4O5V and a molecular weight of 271.13 g/mol. Its IUPAC name is bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium.

Molecular Properties

Compound Namebis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium
PubChem CID59391475
Molecular FormulaC6H12N4O5V
Molecular Weight271.13 g/mol
Exact Mass271.02
IUPAC Namebis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium
SMILESNC(=O)/C=C(/N)O.NC(=O)/C=C(/N)O.O=[V]
InChIInChI=1S/2C3H6N2O2.O.V/c2*4-2(6)1-3(5)7;;/h2*1,6H,4H2,(H2,5,7);;/b2*2-1-;;
InChIKeyOLJPDFZOKPCDCY-SUXDNRKISA-N
XLogP-2.46
TPSA195.75 Ų
H-Bond Donors6
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500271.13
LogP ≤ 5-2.46
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

(Z)-4-amino-2-carbamoyl-4-oxobut-2-enoic acid
CID 22748582
(Z)-2-hydroxybut-2-enediamide
CID 142800168
tris(4-amino-4-hydroxybut-3-en-2-one);iron
CID 147271636
(E)-3-amino-3-chloroprop-2-enamide
CID 88583190
(2Z,4Z)-4-amino-3-hydroxyhexa-2,4-dienamide
CID 135140646
4-amino-3-(aminomethyl)but-2-enamide
CID 88783257
3-amino-4,4-dimethylpent-2-enamide
CID 143267378
(Z)-4-amino-4-oxobut-2-enoic acid;hydrate
CID 88673032
ethene-1,1-diol;prop-2-enamide
CID 174658864
(E)-3,4-diamino-4-oxobut-2-enoic acid
CID 59912426
4-amino-4-oxobut-2-enoic acid;azane
CID 173246306
3-hydroxyhept-2-enamide
CID 148738032

Frequently Asked Questions

What is the IUPAC name of bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium?
The IUPAC name of bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium (CID 59391475) is bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium.
What is the SMILES notation for bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium?
The canonical SMILES for bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium is NC(=O)/C=C(/N)O.NC(=O)/C=C(/N)O.O=[V].
What is the InChIKey of bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium?
The InChIKey is OLJPDFZOKPCDCY-SUXDNRKISA-N. The full InChI is InChI=1S/2C3H6N2O2.O.V/c2*4-2(6)1-3(5)7;;/h2*1,6H,4H2,(H2,5,7);;/b2*2-1-;;.
What are the key properties of bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium?
bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium has a molecular weight of 271.13 g/mol, XLogP of -2.46, 2 rotatable bonds, 6 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for bis((Z)-3-amino-3-hydroxyprop-2-enamide);oxovanadium is sourced from PubChem (CID 59391475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).