(Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile

C15H14N4O — CID 170147729

IUPAC(Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile
SMILESN#C/C(NN)=C(/N)c1ccc(-c2ccc(O)cc2)cc1
InChIInChI=1S/C15H14N4O/c16-9-14(19-18)15(17)12-3-1-10(2-4-12)11-5-7-13(20)8-6-11/h1-8,19-20H,17-18H2/b15-14-
InChIKeyZETKMRIURFNYKW-PFONDFGASA-N
MW266.30 g/mol
LogP1.67
Rot. Bonds3

About (Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile

(Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile (PubChem CID 170147729) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is (Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile.

Molecular Properties

Compound Name(Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile
PubChem CID170147729
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name(Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile
SMILESN#C/C(NN)=C(/N)c1ccc(-c2ccc(O)cc2)cc1
InChIInChI=1S/C15H14N4O/c16-9-14(19-18)15(17)12-3-1-10(2-4-12)11-5-7-13(20)8-6-11/h1-8,19-20H,17-18H2/b15-14-
InChIKeyZETKMRIURFNYKW-PFONDFGASA-N
XLogP1.67
TPSA108.09 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.67
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'conjugated_nitrile_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile?
The IUPAC name of (Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile (CID 170147729) is (Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile.
What is the SMILES notation for (Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile?
The canonical SMILES for (Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile is N#C/C(NN)=C(/N)c1ccc(-c2ccc(O)cc2)cc1.
What is the InChIKey of (Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile?
The InChIKey is ZETKMRIURFNYKW-PFONDFGASA-N. The full InChI is InChI=1S/C15H14N4O/c16-9-14(19-18)15(17)12-3-1-10(2-4-12)11-5-7-13(20)8-6-11/h1-8,19-20H,17-18H2/b15-14-.
What are the key properties of (Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile?
(Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile has a molecular weight of 266.30 g/mol, XLogP of 1.67, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-amino-2-hydrazinyl-3-[4-(4-hydroxyphenyl)phenyl]prop-2-enenitrile is sourced from PubChem (CID 170147729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).