3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine

C18H27NO — CID 115927122

IUPAC3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine
SMILESCOCc1cccc(C2CCNCC2C2CCCC2)c1
InChIInChI=1S/C18H27NO/c1-20-13-14-5-4-8-16(11-14)17-9-10-19-12-18(17)15-6-2-3-7-15/h4-5,8,11,15,17-19H,2-3,6-7,9-10,12-13H2,1H3
InChIKeyORLCDXJRLQHHPP-UHFFFAOYSA-N
MW273.42 g/mol
LogP3.72
Rot. Bonds4

About 3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine

3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine (PubChem CID 115927122) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is 3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine.

Molecular Properties

Compound Name3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine
PubChem CID115927122
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC Name3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine
SMILESCOCc1cccc(C2CCNCC2C2CCCC2)c1
InChIInChI=1S/C18H27NO/c1-20-13-14-5-4-8-16(11-14)17-9-10-19-12-18(17)15-6-2-3-7-15/h4-5,8,11,15,17-19H,2-3,6-7,9-10,12-13H2,1H3
InChIKeyORLCDXJRLQHHPP-UHFFFAOYSA-N
XLogP3.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopentyl-4-[3-(difluoromethyl)phenyl]piperidine
CID 115927082
4-[3-(methoxymethyl)phenyl]-5-methylpyrrolidin-2-one
CID 66106095
3-cyclopentyl-4-(2,4-dimethoxyphenyl)piperidine
CID 115927092
3-(3-chlorophenyl)-4-cyclopentylpiperidine
CID 79431788
(3S)-3-(3-ethylphenyl)pyrrolidine
CID 130943916
5-[[3-(methoxymethyl)phenyl]methyl]-4-methyl-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrole
CID 66213217
2-[3-(methoxymethyl)phenyl]-1,3-dithiane
CID 121001327
4-(3-methylphenyl)-3-phenylmethoxypiperidine
CID 21193252
3-[2-[3-(methoxymethyl)phenoxy]ethyl]piperidine
CID 63986374
N-[[3-(methoxymethyl)phenyl]methyl]cyclohexanamine
CID 54896835
N-[[3-(methoxymethyl)phenyl]methyl]cyclooctanamine
CID 54896500
3-(methoxymethyl)-N-(piperidin-4-ylmethyl)aniline
CID 79707110

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine?
The IUPAC name of 3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine (CID 115927122) is 3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine.
What is the SMILES notation for 3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine?
The canonical SMILES for 3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine is COCc1cccc(C2CCNCC2C2CCCC2)c1.
What is the InChIKey of 3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine?
The InChIKey is ORLCDXJRLQHHPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO/c1-20-13-14-5-4-8-16(11-14)17-9-10-19-12-18(17)15-6-2-3-7-15/h4-5,8,11,15,17-19H,2-3,6-7,9-10,12-13H2,1H3.
What are the key properties of 3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine?
3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine has a molecular weight of 273.42 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-4-[3-(methoxymethyl)phenyl]piperidine is sourced from PubChem (CID 115927122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).