4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol

C16H17N3O — CID 174506798

IUPAC4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol
SMILESCN(C)/N=N/c1ccc(/C=C\c2ccc(O)cc2)cc1
InChIInChI=1S/C16H17N3O/c1-19(2)18-17-15-9-5-13(6-10-15)3-4-14-7-11-16(20)12-8-14/h3-12,20H,1-2H3/b4-3-,18-17+
InChIKeyHQMJVWVWFBDRDK-BOODLRPTSA-N
MW267.33 g/mol
LogP4.12
Rot. Bonds4

About 4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol

4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol (PubChem CID 174506798) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol.

Molecular Properties

Compound Name4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol
PubChem CID174506798
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol
SMILESCN(C)/N=N/c1ccc(/C=C\c2ccc(O)cc2)cc1
InChIInChI=1S/C16H17N3O/c1-19(2)18-17-15-9-5-13(6-10-15)3-4-14-7-11-16(20)12-8-14/h3-12,20H,1-2H3/b4-3-,18-17+
InChIKeyHQMJVWVWFBDRDK-BOODLRPTSA-N
XLogP4.12
TPSA48.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

2-[4-[(E)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenoxy]acetate
CID 58868741
sodium;2-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]benzenesulfonate;dihydrate
CID 157244205
ethane;4-[[4-[(4-hydroxyphenyl)diazenyl]phenyl]diazenyl]benzaldehyde
CID 136654998
[4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenyl]imino-iminoazanium
CID 122609324
4-[6-(4-hydroxyphenyl)hexa-1,3,5-trienyl]phenol
CID 73020850
2-[2-[(E)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenoxy]butanoic acid
CID 69438284
4-[(E)-2-[4-[(E)-2-(4-hydroxyphenyl)ethenyl]phenyl]ethenyl]phenol;triiodovanadium
CID 157160802
4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]phenol
CID 52942315
4-(2-phenylethenyl)phenol
CID 157400568
4-[2-[4-[[4-[2-(3,4-dihydroxyphenyl)ethenyl]phenyl]diazenyl]phenyl]ethenyl]benzene-1,2-diol
CID 136610654
[4-(dimethylaminodiazenyl)phenyl]-(3-hydroxyphenyl)methanone
CID 122463860
4-[(Z)-2-(4-aminophenyl)ethenyl]phenol
CID 25021233

Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol?
The IUPAC name of 4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol (CID 174506798) is 4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol.
What is the SMILES notation for 4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol?
The canonical SMILES for 4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol is CN(C)/N=N/c1ccc(/C=C\c2ccc(O)cc2)cc1.
What is the InChIKey of 4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol?
The InChIKey is HQMJVWVWFBDRDK-BOODLRPTSA-N. The full InChI is InChI=1S/C16H17N3O/c1-19(2)18-17-15-9-5-13(6-10-15)3-4-14-7-11-16(20)12-8-14/h3-12,20H,1-2H3/b4-3-,18-17+.
What are the key properties of 4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol?
4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol has a molecular weight of 267.33 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-2-[4-(dimethylaminodiazenyl)phenyl]ethenyl]phenol is sourced from PubChem (CID 174506798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).