2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene

C20H18 — CID 58787072

IUPAC2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene
SMILESCC/C(=C/c1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C20H18/c1-2-17(14-16-8-4-3-5-9-16)20-13-12-18-10-6-7-11-19(18)15-20/h3-15H,2H2,1H3/b17-14-
InChIKeyFVKUIRKNMZXMPM-VKAVYKQESA-N
MW258.36 g/mol
LogP5.79
Rot. Bonds3

About 2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene

2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene (PubChem CID 58787072) has the molecular formula C20H18 and a molecular weight of 258.36 g/mol. Its IUPAC name is 2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene.

Molecular Properties

Compound Name2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene
PubChem CID58787072
Molecular FormulaC20H18
Molecular Weight258.36 g/mol
Exact Mass258.14
IUPAC Name2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene
SMILESCC/C(=C/c1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C20H18/c1-2-17(14-16-8-4-3-5-9-16)20-13-12-18-10-6-7-11-19(18)15-20/h3-15H,2H2,1H3/b17-14-
InChIKeyFVKUIRKNMZXMPM-VKAVYKQESA-N
XLogP5.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500258.36
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3-(1-phenylbut-1-en-2-yl)phenol
CID 91153074
1-chloro-4-[(E)-1-phenylbut-1-en-2-yl]benzene
CID 138980853
(2E)-2-benzylidene-1-naphthalen-2-ylbutane-1,3-dione
CID 70818111
1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene
CID 22860829
1-chloro-4-[(E)-2-phenylbut-1-enyl]benzene
CID 72793482
ethane;naphthalene-2-carboxylic acid;propane
CID 143443534
actinium;[(Z)-1-naphthalen-2-ylprop-1-enyl]azanide
CID 21343655
(Z)-3-fluoro-2-naphthalen-2-ylprop-2-en-1-ol
CID 70433227
N-benzyl-N-[(Z)-1-naphthalen-2-yl-2-phenylethenyl]acetamide
CID 102487066
2-(1,2-dinaphthalen-2-ylethenyl)naphthalene
CID 171662067
2-[(Z)-2-phenylbut-1-enyl]phenol
CID 11031503
[(Z)-2-(5-methylidenecyclopenten-1-yl)but-1-enyl]benzene
CID 154715098

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene?
The IUPAC name of 2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene (CID 58787072) is 2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene.
What is the SMILES notation for 2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene?
The canonical SMILES for 2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene is CC/C(=C/c1ccccc1)c1ccc2ccccc2c1.
What is the InChIKey of 2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene?
The InChIKey is FVKUIRKNMZXMPM-VKAVYKQESA-N. The full InChI is InChI=1S/C20H18/c1-2-17(14-16-8-4-3-5-9-16)20-13-12-18-10-6-7-11-19(18)15-20/h3-15H,2H2,1H3/b17-14-.
What are the key properties of 2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene?
2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene has a molecular weight of 258.36 g/mol, XLogP of 5.79, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-1-phenylbut-1-en-2-yl]naphthalene is sourced from PubChem (CID 58787072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).