(Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid

C19H14O3 — CID 67704998

IUPAC(Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid
SMILESO=C(O)/C(=C\c1ccc2ccccc2c1)c1ccc(O)cc1
InChIInChI=1S/C19H14O3/c20-17-9-7-15(8-10-17)18(19(21)22)12-13-5-6-14-3-1-2-4-16(14)11-13/h1-12,20H,(H,21,22)/b18-12-
InChIKeyUGUGQTCFYUUQKK-PDGQHHTCSA-N
MW290.32 g/mol
LogP4.17
Rot. Bonds3

About (Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid

(Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid (PubChem CID 67704998) has the molecular formula C19H14O3 and a molecular weight of 290.32 g/mol. Its IUPAC name is (Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid.

Molecular Properties

Compound Name(Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid
PubChem CID67704998
Molecular FormulaC19H14O3
Molecular Weight290.32 g/mol
Exact Mass290.09
IUPAC Name(Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid
SMILESO=C(O)/C(=C\c1ccc2ccccc2c1)c1ccc(O)cc1
InChIInChI=1S/C19H14O3/c20-17-9-7-15(8-10-17)18(19(21)22)12-13-5-6-14-3-1-2-4-16(14)11-13/h1-12,20H,(H,21,22)/b18-12-
InChIKeyUGUGQTCFYUUQKK-PDGQHHTCSA-N
XLogP4.17
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 54.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

(Z)-3-(3-fluorophenyl)-2-(4-hydroxyphenyl)prop-2-enoic acid
CID 83952465
3-(4-fluoro-3-methylphenyl)-2-(4-hydroxyphenyl)prop-2-enoic acid
CID 68771969
actinium;(E)-2-(4-hydroxyphenyl)-3-(4-methylphenyl)prop-2-enoic acid
CID 59099672
(E)-2,3-bis(4-hydroxyphenyl)-1-phenylprop-2-en-1-one
CID 5378867
3-(3-chloro-4-hydroxyphenyl)-2-phenylprop-2-enoic acid
CID 76914513
(Z)-2-(4-hydroxyphenyl)-3-(4-propan-2-yloxyphenyl)prop-2-enoic acid
CID 83951842
2-(1,2-dinaphthalen-2-ylethenyl)naphthalene
CID 171662067
(Z)-3-(4-hydroxyphenyl)-2-(3-methoxyphenyl)prop-2-enoic acid
CID 83950730
(Z)-2-(3-hydroxyphenyl)-3-(3-phenoxyphenyl)prop-2-enoic acid
CID 83951696
(E)-3-(6-hydroxynaphthalen-2-yl)-1-naphthalen-2-ylprop-2-en-1-one
CID 89077412
naphthalene-2-carboxylic acid;naphthalen-2-ol
CID 161405760
2-(4-hydroxyphenyl)-3-quinolin-3-ylprop-2-enamide
CID 54293245

Frequently Asked Questions

What is the IUPAC name of (Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid?
The IUPAC name of (Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid (CID 67704998) is (Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid.
What is the SMILES notation for (Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid?
The canonical SMILES for (Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid is O=C(O)/C(=C\c1ccc2ccccc2c1)c1ccc(O)cc1.
What is the InChIKey of (Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid?
The InChIKey is UGUGQTCFYUUQKK-PDGQHHTCSA-N. The full InChI is InChI=1S/C19H14O3/c20-17-9-7-15(8-10-17)18(19(21)22)12-13-5-6-14-3-1-2-4-16(14)11-13/h1-12,20H,(H,21,22)/b18-12-.
What are the key properties of (Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid?
(Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid has a molecular weight of 290.32 g/mol, XLogP of 4.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-(4-hydroxyphenyl)-3-naphthalen-2-ylprop-2-enoic acid is sourced from PubChem (CID 67704998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).