(Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile

C7H5NO2 — CID 119089971

IUPAC(Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile
SMILESN#C/C(=C/O)c1ccco1
InChIInChI=1S/C7H5NO2/c8-4-6(5-9)7-2-1-3-10-7/h1-3,5,9H/b6-5-
InChIKeyOZVOEEFIKIAVPL-WAYWQWQTSA-N
MW135.12 g/mol
LogP1.70
Rot. Bonds1

About (Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile

(Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile (PubChem CID 119089971) has the molecular formula C7H5NO2 and a molecular weight of 135.12 g/mol. Its IUPAC name is (Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile.

Molecular Properties

Compound Name(Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile
PubChem CID119089971
Molecular FormulaC7H5NO2
Molecular Weight135.12 g/mol
Exact Mass135.03
IUPAC Name(Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile
SMILESN#C/C(=C/O)c1ccco1
InChIInChI=1S/C7H5NO2/c8-4-6(5-9)7-2-1-3-10-7/h1-3,5,9H/b6-5-
InChIKeyOZVOEEFIKIAVPL-WAYWQWQTSA-N
XLogP1.70
TPSA57.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.12
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-amino-3-(furan-2-yl)prop-2-enenitrile
CID 69283548
3-(furan-2-yl)pent-2-enenitrile
CID 71383305
5-amino-3-[(Z)-2-cyano-2-(furan-2-yl)ethenyl]-1-phenylpyrazole-4-carbonitrile
CID 92970259
ethane;(E)-3-(furan-2-yl)pent-2-enenitrile
CID 159560899
5-amino-3-[(Z)-2-cyano-2-(furan-2-yl)ethenyl]-1-(2-hydroxyethyl)pyrazole-4-carbonitrile
CID 56687805
N'-cyanofuran-2-carboximidamide;hydrochloride
CID 75485317
(Z)-3-amino-2-(furan-2-carbonyl)but-2-enenitrile
CID 11332786
(Z)-3-hydroxy-2-thiophen-2-ylprop-2-enenitrile
CID 98114034
2-[(3E)-4-methylhexa-1,3,5-trien-3-yl]furan
CID 155692254
2-[(E)-1-chloroprop-1-enyl]furan
CID 170605164
calcium;bis(furan-2-carboxylate);hydrate
CID 160535503
furan-2-carboxamide;molecular hydrogen
CID 145259960

Frequently Asked Questions

What is the IUPAC name of (Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile?
The IUPAC name of (Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile (CID 119089971) is (Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile.
What is the SMILES notation for (Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile?
The canonical SMILES for (Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile is N#C/C(=C/O)c1ccco1.
What is the InChIKey of (Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile?
The InChIKey is OZVOEEFIKIAVPL-WAYWQWQTSA-N. The full InChI is InChI=1S/C7H5NO2/c8-4-6(5-9)7-2-1-3-10-7/h1-3,5,9H/b6-5-.
What are the key properties of (Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile?
(Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile has a molecular weight of 135.12 g/mol, XLogP of 1.70, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(furan-2-yl)-3-hydroxyprop-2-enenitrile is sourced from PubChem (CID 119089971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).