4-naphthalen-2-ylbut-3-en-1-ol

C14H14O — CID 54291326

IUPAC4-naphthalen-2-ylbut-3-en-1-ol
SMILESOCCC=Cc1ccc2ccccc2c1
InChIInChI=1S/C14H14O/c15-10-4-3-5-12-8-9-13-6-1-2-7-14(13)11-12/h1-3,5-9,11,15H,4,10H2
InChIKeyRXSFFEOOCHQWBM-UHFFFAOYSA-N
MW198.26 g/mol
LogP3.24
Rot. Bonds3

About 4-naphthalen-2-ylbut-3-en-1-ol

4-naphthalen-2-ylbut-3-en-1-ol (PubChem CID 54291326) has the molecular formula C14H14O and a molecular weight of 198.26 g/mol. Its IUPAC name is 4-naphthalen-2-ylbut-3-en-1-ol.

Molecular Properties

Compound Name4-naphthalen-2-ylbut-3-en-1-ol
PubChem CID54291326
Molecular FormulaC14H14O
Molecular Weight198.26 g/mol
Exact Mass198.10
IUPAC Name4-naphthalen-2-ylbut-3-en-1-ol
SMILESOCCC=Cc1ccc2ccccc2c1
InChIInChI=1S/C14H14O/c15-10-4-3-5-12-8-9-13-6-1-2-7-14(13)11-12/h1-3,5-9,11,15H,4,10H2
InChIKeyRXSFFEOOCHQWBM-UHFFFAOYSA-N
XLogP3.24
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.26
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2-[(E)-3-chloroprop-1-enyl]naphthalene
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2-[(E)-dodec-1-enyl]naphthalene
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2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
CID 20801533
2-naphthalen-2-ylethenol
CID 67195423
2-[(E)-4-methylpent-1-enyl]naphthalene
CID 15318830
6-(4-hydroxybut-1-enyl)-2H-isoquinolin-3-one
CID 170477313
4-(1H-indol-6-yl)but-3-en-1-ol
CID 170476703
2-(4-hydroxybut-1-enyl)fluoren-9-one
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Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-2-ylbut-3-en-1-ol?
The IUPAC name of 4-naphthalen-2-ylbut-3-en-1-ol (CID 54291326) is 4-naphthalen-2-ylbut-3-en-1-ol.
What is the SMILES notation for 4-naphthalen-2-ylbut-3-en-1-ol?
The canonical SMILES for 4-naphthalen-2-ylbut-3-en-1-ol is OCCC=Cc1ccc2ccccc2c1.
What is the InChIKey of 4-naphthalen-2-ylbut-3-en-1-ol?
The InChIKey is RXSFFEOOCHQWBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O/c15-10-4-3-5-12-8-9-13-6-1-2-7-14(13)11-12/h1-3,5-9,11,15H,4,10H2.
What are the key properties of 4-naphthalen-2-ylbut-3-en-1-ol?
4-naphthalen-2-ylbut-3-en-1-ol has a molecular weight of 198.26 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-2-ylbut-3-en-1-ol is sourced from PubChem (CID 54291326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).