2-[2-(cyclopentylmethoxy)phenyl]naphthalene

C22H22O — CID 91262762

IUPAC2-[2-(cyclopentylmethoxy)phenyl]naphthalene
SMILESc1ccc(-c2ccc3ccccc3c2)c(OCC2CCCC2)c1
InChIInChI=1S/C22H22O/c1-2-8-17(7-1)16-23-22-12-6-5-11-21(22)20-14-13-18-9-3-4-10-19(18)15-20/h3-6,9-15,17H,1-2,7-8,16H2
InChIKeyXDISDRYOJHRSJC-UHFFFAOYSA-N
MW302.42 g/mol
LogP6.08
Rot. Bonds4

About 2-[2-(cyclopentylmethoxy)phenyl]naphthalene

2-[2-(cyclopentylmethoxy)phenyl]naphthalene (PubChem CID 91262762) has the molecular formula C22H22O and a molecular weight of 302.42 g/mol. Its IUPAC name is 2-[2-(cyclopentylmethoxy)phenyl]naphthalene.

Molecular Properties

Compound Name2-[2-(cyclopentylmethoxy)phenyl]naphthalene
PubChem CID91262762
Molecular FormulaC22H22O
Molecular Weight302.42 g/mol
Exact Mass302.17
IUPAC Name2-[2-(cyclopentylmethoxy)phenyl]naphthalene
SMILESc1ccc(-c2ccc3ccccc3c2)c(OCC2CCCC2)c1
InChIInChI=1S/C22H22O/c1-2-8-17(7-1)16-23-22-12-6-5-11-21(22)20-14-13-18-9-3-4-10-19(18)15-20/h3-6,9-15,17H,1-2,7-8,16H2
InChIKeyXDISDRYOJHRSJC-UHFFFAOYSA-N
XLogP6.08
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.42
LogP ≤ 56.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-naphthalen-2-ylphenoxy)acetic acid
CID 139923485
1-(cyclopentylmethoxy)-2-methylbenzene
CID 59117156
1-(cyclohexylmethoxy)-4-phenylbenzene
CID 59950067
6-[5-(2-carboxyethyl)-2-(cyclohexylmethoxy)phenyl]naphthalene-2-carboxylic acid
CID 22558817
1-bromo-2-[3-(cyclohexylmethoxy)phenyl]benzene
CID 166449839
1-(bromomethyl)-2-(cyclopentylmethoxy)benzene
CID 61343019
(2-naphthalen-2-ylphenoxy)boronic acid
CID 150538164
(3R)-3-[(2-phenylphenoxy)methyl]piperidine
CID 26190683
cyclohexylmethoxybenzene
CID 14399287
[4-(cyclohexylmethoxy)naphthalen-1-yl]-naphthalen-1-yl-naphthalen-2-ylsulfanium
CID 165036943
3-[4-(cyclohexylmethoxy)-3-(6-hydroxynaphthalen-2-yl)phenyl]-2-methylpropanoic acid
CID 68825492
4-[(2-methoxy-6-naphthalen-2-ylphenyl)methyl]piperidine
CID 17039512

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopentylmethoxy)phenyl]naphthalene?
The IUPAC name of 2-[2-(cyclopentylmethoxy)phenyl]naphthalene (CID 91262762) is 2-[2-(cyclopentylmethoxy)phenyl]naphthalene.
What is the SMILES notation for 2-[2-(cyclopentylmethoxy)phenyl]naphthalene?
The canonical SMILES for 2-[2-(cyclopentylmethoxy)phenyl]naphthalene is c1ccc(-c2ccc3ccccc3c2)c(OCC2CCCC2)c1.
What is the InChIKey of 2-[2-(cyclopentylmethoxy)phenyl]naphthalene?
The InChIKey is XDISDRYOJHRSJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22O/c1-2-8-17(7-1)16-23-22-12-6-5-11-21(22)20-14-13-18-9-3-4-10-19(18)15-20/h3-6,9-15,17H,1-2,7-8,16H2.
What are the key properties of 2-[2-(cyclopentylmethoxy)phenyl]naphthalene?
2-[2-(cyclopentylmethoxy)phenyl]naphthalene has a molecular weight of 302.42 g/mol, XLogP of 6.08, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopentylmethoxy)phenyl]naphthalene is sourced from PubChem (CID 91262762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).