1-(cyclohexylidenemethyl)naphthalene

C17H18 — CID 15459219

IUPAC1-(cyclohexylidenemethyl)naphthalene
SMILESC(=C1CCCCC1)c1cccc2ccccc12
InChIInChI=1S/C17H18/c1-2-7-14(8-3-1)13-16-11-6-10-15-9-4-5-12-17(15)16/h4-6,9-13H,1-3,7-8H2
InChIKeyPCZKGIKXDLIEEQ-UHFFFAOYSA-N
MW222.33 g/mol
LogP5.19
Rot. Bonds1

About 1-(cyclohexylidenemethyl)naphthalene

1-(cyclohexylidenemethyl)naphthalene (PubChem CID 15459219) has the molecular formula C17H18 and a molecular weight of 222.33 g/mol. Its IUPAC name is 1-(cyclohexylidenemethyl)naphthalene.

Molecular Properties

Compound Name1-(cyclohexylidenemethyl)naphthalene
PubChem CID15459219
Molecular FormulaC17H18
Molecular Weight222.33 g/mol
Exact Mass222.14
IUPAC Name1-(cyclohexylidenemethyl)naphthalene
SMILESC(=C1CCCCC1)c1cccc2ccccc12
InChIInChI=1S/C17H18/c1-2-7-14(8-3-1)13-16-11-6-10-15-9-4-5-12-17(15)16/h4-6,9-13H,1-3,7-8H2
InChIKeyPCZKGIKXDLIEEQ-UHFFFAOYSA-N
XLogP5.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500222.33
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylidenemethyl)naphthalene?
The IUPAC name of 1-(cyclohexylidenemethyl)naphthalene (CID 15459219) is 1-(cyclohexylidenemethyl)naphthalene.
What is the SMILES notation for 1-(cyclohexylidenemethyl)naphthalene?
The canonical SMILES for 1-(cyclohexylidenemethyl)naphthalene is C(=C1CCCCC1)c1cccc2ccccc12.
What is the InChIKey of 1-(cyclohexylidenemethyl)naphthalene?
The InChIKey is PCZKGIKXDLIEEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18/c1-2-7-14(8-3-1)13-16-11-6-10-15-9-4-5-12-17(15)16/h4-6,9-13H,1-3,7-8H2.
What are the key properties of 1-(cyclohexylidenemethyl)naphthalene?
1-(cyclohexylidenemethyl)naphthalene has a molecular weight of 222.33 g/mol, XLogP of 5.19, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylidenemethyl)naphthalene is sourced from PubChem (CID 15459219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).