2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine

C16H23NO — CID 117366157

IUPAC2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine
SMILESCC1(c2ccc(OC3CCCC3)cc2)CCCN1
InChIInChI=1S/C16H23NO/c1-16(11-4-12-17-16)13-7-9-15(10-8-13)18-14-5-2-3-6-14/h7-10,14,17H,2-6,11-12H2,1H3
InChIKeyYSHRGXQYYUDBKN-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.61
Rot. Bonds3

About 2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine

2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine (PubChem CID 117366157) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is 2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine.

Molecular Properties

Compound Name2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine
PubChem CID117366157
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC Name2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine
SMILESCC1(c2ccc(OC3CCCC3)cc2)CCCN1
InChIInChI=1S/C16H23NO/c1-16(11-4-12-17-16)13-7-9-15(10-8-13)18-14-5-2-3-6-14/h7-10,14,17H,2-6,11-12H2,1H3
InChIKeyYSHRGXQYYUDBKN-UHFFFAOYSA-N
XLogP3.61
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-3-[4-(2-methylpyrrolidin-2-yl)phenoxy]piperidine
CID 117438903
2-methyl-2-[4-(2-methylprop-2-enoxy)phenyl]pyrrolidine
CID 117335007
2-methyl-2-[4-[(3-methyloxetan-3-yl)methoxy]phenyl]pyrrolidine
CID 117408371
1-(4-cyclopentyloxyphenyl)cyclopentan-1-amine
CID 82294898
2-(3-chloro-4-cyclohexylphenyl)-2-methylpyrrolidine
CID 117445362
4-(2-methylazepan-2-yl)phenol
CID 115059442
2-[3-(cyclobutylmethoxy)-5-fluorophenyl]-2-methylpyrrolidine
CID 117413305
2-[3-methoxy-4-(thiolan-3-yloxy)phenyl]-2-methylpyrrolidine
CID 117473686
2-methyl-2-[4-(2-methylbutan-2-yl)phenyl]pyrrolidine
CID 117335142
2-[4-(difluoromethylsulfanyl)phenyl]-2-methylpyrrolidine
CID 117360520
[4-(4-methylphenoxy)piperidin-1-yl]-[(2R)-2-methylpyrrolidin-2-yl]methanone
CID 138050980
1-bromo-4-cyclopentyloxybenzene
CID 22599958

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine?
The IUPAC name of 2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine (CID 117366157) is 2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine.
What is the SMILES notation for 2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine?
The canonical SMILES for 2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine is CC1(c2ccc(OC3CCCC3)cc2)CCCN1.
What is the InChIKey of 2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine?
The InChIKey is YSHRGXQYYUDBKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c1-16(11-4-12-17-16)13-7-9-15(10-8-13)18-14-5-2-3-6-14/h7-10,14,17H,2-6,11-12H2,1H3.
What are the key properties of 2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine?
2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine has a molecular weight of 245.37 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopentyloxyphenyl)-2-methylpyrrolidine is sourced from PubChem (CID 117366157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).