2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene

C25H20O2 — CID 135028024

IUPAC2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene
SMILESC(=C(/COc1ccccc1)Oc1ccccc1)\c1ccc2ccccc2c1
InChIInChI=1S/C25H20O2/c1-3-11-23(12-4-1)26-19-25(27-24-13-5-2-6-14-24)18-20-15-16-21-9-7-8-10-22(21)17-20/h1-18H,19H2/b25-18-
InChIKeyKOSCXXWFYDLARX-BWAHOGKJSA-N
MW352.43 g/mol
LogP6.34
Rot. Bonds6

About 2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene

2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene (PubChem CID 135028024) has the molecular formula C25H20O2 and a molecular weight of 352.43 g/mol. Its IUPAC name is 2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene.

Molecular Properties

Compound Name2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene
PubChem CID135028024
Molecular FormulaC25H20O2
Molecular Weight352.43 g/mol
Exact Mass352.15
IUPAC Name2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene
SMILESC(=C(/COc1ccccc1)Oc1ccccc1)\c1ccc2ccccc2c1
InChIInChI=1S/C25H20O2/c1-3-11-23(12-4-1)26-19-25(27-24-13-5-2-6-14-24)18-20-15-16-21-9-7-8-10-22(21)17-20/h1-18H,19H2/b25-18-
InChIKeyKOSCXXWFYDLARX-BWAHOGKJSA-N
XLogP6.34
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.43
LogP ≤ 56.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-bromo-2-fluoroethenyl)naphthalene
CID 71421108
naphthalene;2-phenoxyacetic acid
CID 175275275
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CID 20741960
2-(1,2-dinaphthalen-2-ylethenyl)naphthalene
CID 171662067
(Z)-2-fluoro-3-naphthalen-2-yl-1-phenylprop-2-en-1-ol
CID 11482836
2-(2,2-diphenylethenyl)-6-[2-[6-(2-naphthalen-2-ylethenyl)naphthalen-2-yl]ethenyl]naphthalene
CID 72565680
dibenzyl 2-(naphthalen-2-ylmethylidene)propanedioate
CID 164672547
2-(2,2-diphenylethenyl)anthracene
CID 155667641
trimethyl-(2-naphthalen-2-yl-1-trimethylsilylethenyl)silane
CID 101475469
(4-cyanophenyl) 2-naphthalen-2-yloxyacetate
CID 4095400
3-methyl-2-(naphthalen-2-ylmethylidene)-N-propan-2-ylbutan-1-amine
CID 79339001
2-(naphthalen-2-ylmethylideneamino)oxyacetic acid
CID 77013552

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene?
The IUPAC name of 2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene (CID 135028024) is 2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene.
What is the SMILES notation for 2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene?
The canonical SMILES for 2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene is C(=C(/COc1ccccc1)Oc1ccccc1)\c1ccc2ccccc2c1.
What is the InChIKey of 2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene?
The InChIKey is KOSCXXWFYDLARX-BWAHOGKJSA-N. The full InChI is InChI=1S/C25H20O2/c1-3-11-23(12-4-1)26-19-25(27-24-13-5-2-6-14-24)18-20-15-16-21-9-7-8-10-22(21)17-20/h1-18H,19H2/b25-18-.
What are the key properties of 2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene?
2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene has a molecular weight of 352.43 g/mol, XLogP of 6.34, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-2,3-diphenoxyprop-1-enyl]naphthalene is sourced from PubChem (CID 135028024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).