4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol

C13H10ClNO — CID 150300017

IUPAC4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol
SMILESOc1ccc(Cl)cc1/C=C/c1ccncc1
InChIInChI=1S/C13H10ClNO/c14-12-3-4-13(16)11(9-12)2-1-10-5-7-15-8-6-10/h1-9,16H/b2-1+
InChIKeyGJKCRVJFJOVLCQ-OWOJBTEDSA-N
MW231.68 g/mol
LogP3.61
Rot. Bonds2

About 4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol

4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol (PubChem CID 150300017) has the molecular formula C13H10ClNO and a molecular weight of 231.68 g/mol. Its IUPAC name is 4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol.

Molecular Properties

Compound Name4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol
PubChem CID150300017
Molecular FormulaC13H10ClNO
Molecular Weight231.68 g/mol
Exact Mass231.05
IUPAC Name4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol
SMILESOc1ccc(Cl)cc1/C=C/c1ccncc1
InChIInChI=1S/C13H10ClNO/c14-12-3-4-13(16)11(9-12)2-1-10-5-7-15-8-6-10/h1-9,16H/b2-1+
InChIKeyGJKCRVJFJOVLCQ-OWOJBTEDSA-N
XLogP3.61
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.68
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-[2,4,5-tris(2-pyridin-4-ylethenyl)phenyl]ethenyl]pyridine
CID 86183195
4-(2-pyridin-4-ylethenyl)benzene-1,2-diol;hydrobromide
CID 173142705
3-(5-chloro-2-hydroxyphenyl)prop-2-enenitrile
CID 169483116
2-[(E)-2-(3-chlorophenyl)ethenyl]-4-nitrosophenol
CID 142621773
4-[2-(2-chloro-4-methylphenyl)ethenyl]pyridine
CID 176726563
4-(2-pyridin-4-ylethenyl)-2-[4-[(E)-2-pyridin-4-ylethenyl]-2-pyridinyl]pyridine
CID 154284100
4-[2-(2-fluoro-4-methylphenyl)ethenyl]pyridine
CID 176726557
2-(2-phenylethenyl)benzene-1,4-diol
CID 54196246
4-chloro-2-[(E)-2-phenylethenyl]benzamide
CID 10106537
4-chloro-2-[(E)-2-(2,4-dinitrophenyl)ethenyl]phenol
CID 6083825
(E)-3-(2,5-dichlorophenyl)-1-pyridin-4-ylprop-2-en-1-one
CID 178162630
2-methoxy-5-(2-pyridin-4-ylethenyl)phenol
CID 54474523

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol?
The IUPAC name of 4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol (CID 150300017) is 4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol.
What is the SMILES notation for 4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol?
The canonical SMILES for 4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol is Oc1ccc(Cl)cc1/C=C/c1ccncc1.
What is the InChIKey of 4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol?
The InChIKey is GJKCRVJFJOVLCQ-OWOJBTEDSA-N. The full InChI is InChI=1S/C13H10ClNO/c14-12-3-4-13(16)11(9-12)2-1-10-5-7-15-8-6-10/h1-9,16H/b2-1+.
What are the key properties of 4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol?
4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol has a molecular weight of 231.68 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-[(E)-2-pyridin-4-ylethenyl]phenol is sourced from PubChem (CID 150300017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).