(5-cyclohexyl-3-methoxypentyl)benzene

C18H28O — CID 143381268

IUPAC(5-cyclohexyl-3-methoxypentyl)benzene
SMILESCOC(CCc1ccccc1)CCC1CCCCC1
InChIInChI=1S/C18H28O/c1-19-18(14-12-16-8-4-2-5-9-16)15-13-17-10-6-3-7-11-17/h2,4-5,8-9,17-18H,3,6-7,10-15H2,1H3
InChIKeyHRPRMQAEDFFYOM-UHFFFAOYSA-N
MW260.42 g/mol
LogP4.99
Rot. Bonds7

About (5-cyclohexyl-3-methoxypentyl)benzene

(5-cyclohexyl-3-methoxypentyl)benzene (PubChem CID 143381268) has the molecular formula C18H28O and a molecular weight of 260.42 g/mol. Its IUPAC name is (5-cyclohexyl-3-methoxypentyl)benzene.

Molecular Properties

Compound Name(5-cyclohexyl-3-methoxypentyl)benzene
PubChem CID143381268
Molecular FormulaC18H28O
Molecular Weight260.42 g/mol
Exact Mass260.21
IUPAC Name(5-cyclohexyl-3-methoxypentyl)benzene
SMILESCOC(CCc1ccccc1)CCC1CCCCC1
InChIInChI=1S/C18H28O/c1-19-18(14-12-16-8-4-2-5-9-16)15-13-17-10-6-3-7-11-17/h2,4-5,8-9,17-18H,3,6-7,10-15H2,1H3
InChIKeyHRPRMQAEDFFYOM-UHFFFAOYSA-N
XLogP4.99
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.42
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (5-cyclohexyl-3-methoxypentyl)benzene?
The IUPAC name of (5-cyclohexyl-3-methoxypentyl)benzene (CID 143381268) is (5-cyclohexyl-3-methoxypentyl)benzene.
What is the SMILES notation for (5-cyclohexyl-3-methoxypentyl)benzene?
The canonical SMILES for (5-cyclohexyl-3-methoxypentyl)benzene is COC(CCc1ccccc1)CCC1CCCCC1.
What is the InChIKey of (5-cyclohexyl-3-methoxypentyl)benzene?
The InChIKey is HRPRMQAEDFFYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28O/c1-19-18(14-12-16-8-4-2-5-9-16)15-13-17-10-6-3-7-11-17/h2,4-5,8-9,17-18H,3,6-7,10-15H2,1H3.
What are the key properties of (5-cyclohexyl-3-methoxypentyl)benzene?
(5-cyclohexyl-3-methoxypentyl)benzene has a molecular weight of 260.42 g/mol, XLogP of 4.99, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclohexyl-3-methoxypentyl)benzene is sourced from PubChem (CID 143381268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).