2-(4-phenoxybut-2-en-2-yl)naphthalene

C20H18O — CID 141037566

IUPAC2-(4-phenoxybut-2-en-2-yl)naphthalene
SMILESCC(=CCOc1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C20H18O/c1-16(13-14-21-20-9-3-2-4-10-20)18-12-11-17-7-5-6-8-19(17)15-18/h2-13,15H,14H2,1H3
InChIKeyWFUKHUXVGLMEBW-UHFFFAOYSA-N
MW274.36 g/mol
LogP5.32
Rot. Bonds4

About 2-(4-phenoxybut-2-en-2-yl)naphthalene

2-(4-phenoxybut-2-en-2-yl)naphthalene (PubChem CID 141037566) has the molecular formula C20H18O and a molecular weight of 274.36 g/mol. Its IUPAC name is 2-(4-phenoxybut-2-en-2-yl)naphthalene.

Molecular Properties

Compound Name2-(4-phenoxybut-2-en-2-yl)naphthalene
PubChem CID141037566
Molecular FormulaC20H18O
Molecular Weight274.36 g/mol
Exact Mass274.14
IUPAC Name2-(4-phenoxybut-2-en-2-yl)naphthalene
SMILESCC(=CCOc1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C20H18O/c1-16(13-14-21-20-9-3-2-4-10-20)18-12-11-17-7-5-6-8-19(17)15-18/h2-13,15H,14H2,1H3
InChIKeyWFUKHUXVGLMEBW-UHFFFAOYSA-N
XLogP5.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.36
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(1-phenoxyprop-1-en-2-yl)naphthalene
CID 175768409
(E)-2-naphthalen-2-ylprop-1-en-1-ol
CID 70376926
2-[(2E)-5-methylhexa-2,5-dien-2-yl]naphthalene;1,4-xylene
CID 142975570
2-[(2Z,8E)-undeca-2,8-dien-2-yl]naphthalene
CID 172611470
2-[(8Z)-undeca-2,8-dien-2-yl]naphthalene
CID 172611459
methyl 2-[4-[(E)-3-(4-phenoxyphenyl)but-2-enoxy]phenyl]acetate
CID 10293637
(2R)-2-(4-naphthalen-2-ylpent-3-enoxy)butanedioic acid
CID 67581402
methyl 3-naphthalen-2-ylbut-2-enoate
CID 54449907
(Z)-4-(4-methoxyphenoxy)-2-phenylbut-2-en-1-ol
CID 134970181
3-naphthalen-2-ylbut-2-enoyl chloride
CID 91215732
1-bromo-4-[(Z)-4-(4-methylphenoxy)but-2-en-2-yl]benzene
CID 70944733
N-(1-naphthalen-2-ylethylideneamino)-2-phenoxyacetamide
CID 913446

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenoxybut-2-en-2-yl)naphthalene?
The IUPAC name of 2-(4-phenoxybut-2-en-2-yl)naphthalene (CID 141037566) is 2-(4-phenoxybut-2-en-2-yl)naphthalene.
What is the SMILES notation for 2-(4-phenoxybut-2-en-2-yl)naphthalene?
The canonical SMILES for 2-(4-phenoxybut-2-en-2-yl)naphthalene is CC(=CCOc1ccccc1)c1ccc2ccccc2c1.
What is the InChIKey of 2-(4-phenoxybut-2-en-2-yl)naphthalene?
The InChIKey is WFUKHUXVGLMEBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18O/c1-16(13-14-21-20-9-3-2-4-10-20)18-12-11-17-7-5-6-8-19(17)15-18/h2-13,15H,14H2,1H3.
What are the key properties of 2-(4-phenoxybut-2-en-2-yl)naphthalene?
2-(4-phenoxybut-2-en-2-yl)naphthalene has a molecular weight of 274.36 g/mol, XLogP of 5.32, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenoxybut-2-en-2-yl)naphthalene is sourced from PubChem (CID 141037566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).