(Z)-5-hydroxypent-3-enenitrile

C5H7NO — CID 10909494

IUPAC(Z)-5-hydroxypent-3-enenitrile
SMILESN#CC/C=C\CO
InChIInChI=1S/C5H7NO/c6-4-2-1-3-5-7/h1,3,7H,2,5H2/b3-1-
InChIKeyWPVGCOZUWLMELF-IWQZZHSRSA-N
MW97.12 g/mol
LogP0.45
Rot. Bonds2

About (Z)-5-hydroxypent-3-enenitrile

(Z)-5-hydroxypent-3-enenitrile (PubChem CID 10909494) has the molecular formula C5H7NO and a molecular weight of 97.12 g/mol. Its IUPAC name is (Z)-5-hydroxypent-3-enenitrile.

Molecular Properties

Compound Name(Z)-5-hydroxypent-3-enenitrile
PubChem CID10909494
Molecular FormulaC5H7NO
Molecular Weight97.12 g/mol
Exact Mass97.05
IUPAC Name(Z)-5-hydroxypent-3-enenitrile
SMILESN#CC/C=C\CO
InChIInChI=1S/C5H7NO/c6-4-2-1-3-5-7/h1,3,7H,2,5H2/b3-1-
InChIKeyWPVGCOZUWLMELF-IWQZZHSRSA-N
XLogP0.45
TPSA44.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.12
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (Z)-5-hydroxypent-3-enenitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(R,E)-2-Hydroxy-3-pentenenitrile
CID 11137099
(2S,3E)-2-hydroxypent-3-enenitrile
CID 10909491
(2S,3E)-2-hydroxyhept-3-enenitrile
CID 55265295
(E)-4-hydroxypent-2-enenitrile
CID 11137097
CID 245627
CID 245627
2-Hydroxypent-3-enenitrile
CID 5949985
(E)-5-hydroxypent-3-enenitrile
CID 15256586
(r)-2-Hydroxy-3-pentenenitrile
CID 53648315
4-Hydroxypent-2-enenitrile
CID 53973376
(2R,3E,5E)-2-hydroxyhepta-3,5-dienenitrile
CID 11007888
(4Z,6E)-8-hydroxyocta-4,6-dienenitrile
CID 134863896
5-Hydroxy-4-methylpent-3-enenitrile
CID 53426742

Frequently Asked Questions

What is the IUPAC name of (Z)-5-hydroxypent-3-enenitrile?
The IUPAC name of (Z)-5-hydroxypent-3-enenitrile (CID 10909494) is (Z)-5-hydroxypent-3-enenitrile.
What is the SMILES notation for (Z)-5-hydroxypent-3-enenitrile?
The canonical SMILES for (Z)-5-hydroxypent-3-enenitrile is N#CC/C=C\CO.
What is the InChIKey of (Z)-5-hydroxypent-3-enenitrile?
The InChIKey is WPVGCOZUWLMELF-IWQZZHSRSA-N. The full InChI is InChI=1S/C5H7NO/c6-4-2-1-3-5-7/h1,3,7H,2,5H2/b3-1-.
What are the key properties of (Z)-5-hydroxypent-3-enenitrile?
(Z)-5-hydroxypent-3-enenitrile has a molecular weight of 97.12 g/mol, XLogP of 0.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-hydroxypent-3-enenitrile is sourced from PubChem (CID 10909494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).