3-(4-methoxyphenyl)piperidine

C12H17NO — CID 12937920

IUPAC3-(4-methoxyphenyl)piperidine
SMILESCOc1ccc(C2CCCNC2)cc1
InChIInChI=1S/C12H17NO/c1-14-12-6-4-10(5-7-12)11-3-2-8-13-9-11/h4-7,11,13H,2-3,8-9H2,1H3
InChIKeyXOFIBRNSGSEFHC-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.16
Rot. Bonds2

About 3-(4-methoxyphenyl)piperidine

3-(4-methoxyphenyl)piperidine (PubChem CID 12937920) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)piperidine.

Molecular Properties

Compound Name3-(4-methoxyphenyl)piperidine
PubChem CID12937920
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name3-(4-methoxyphenyl)piperidine
SMILESCOc1ccc(C2CCCNC2)cc1
InChIInChI=1S/C12H17NO/c1-14-12-6-4-10(5-7-12)11-3-2-8-13-9-11/h4-7,11,13H,2-3,8-9H2,1H3
InChIKeyXOFIBRNSGSEFHC-UHFFFAOYSA-N
XLogP2.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4S)-4-(4-methoxyphenyl)azepane
CID 95439149
3-[4-(difluoromethoxy)phenyl]piperidine
CID 117326655
2-(4-methoxyphenyl)-4-piperidin-3-ylpyridine;hydrochloride
CID 118741830
bromomethane;1-cyclopentyl-4-methoxybenzene
CID 160663013
3-[4-(1-methoxyethyl)phenyl]piperidine
CID 117313118
3-(4-tert-butylphenyl)piperidine
CID 24904200
2-(4-methoxyphenyl)-1,4-diazocane
CID 2771778
2-methoxy-5-[(3R)-piperidin-3-yl]pyridine
CID 93478601
3-(4-propan-2-ylphenyl)piperidine
CID 58015975
3-[4-(4-methoxyphenyl)-1H-pyrazol-5-yl]piperidine
CID 82380463
4-piperidin-3-ylpyridine;dihydrochloride
CID 91809614
3-[4-(thietan-3-yl)phenyl]piperidine
CID 115006012

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)piperidine?
The IUPAC name of 3-(4-methoxyphenyl)piperidine (CID 12937920) is 3-(4-methoxyphenyl)piperidine.
What is the SMILES notation for 3-(4-methoxyphenyl)piperidine?
The canonical SMILES for 3-(4-methoxyphenyl)piperidine is COc1ccc(C2CCCNC2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)piperidine?
The InChIKey is XOFIBRNSGSEFHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-14-12-6-4-10(5-7-12)11-3-2-8-13-9-11/h4-7,11,13H,2-3,8-9H2,1H3.
What are the key properties of 3-(4-methoxyphenyl)piperidine?
3-(4-methoxyphenyl)piperidine has a molecular weight of 191.27 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)piperidine is sourced from PubChem (CID 12937920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).