1-(4-methoxyphenyl)piperidine

C12H17NO — CID 10130315

IUPAC1-(4-methoxyphenyl)piperidine
SMILESCOc1ccc(N2CCCCC2)cc1
InChIInChI=1S/C12H17NO/c1-14-12-7-5-11(6-8-12)13-9-3-2-4-10-13/h5-8H,2-4,9-10H2,1H3
InChIKeyPEBHYIWLEXUDPC-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.69
Rot. Bonds2

About 1-(4-methoxyphenyl)piperidine

1-(4-methoxyphenyl)piperidine (PubChem CID 10130315) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)piperidine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)piperidine
PubChem CID10130315
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name1-(4-methoxyphenyl)piperidine
SMILESCOc1ccc(N2CCCCC2)cc1
InChIInChI=1S/C12H17NO/c1-14-12-7-5-11(6-8-12)13-9-3-2-4-10-13/h5-8H,2-4,9-10H2,1H3
InChIKeyPEBHYIWLEXUDPC-UHFFFAOYSA-N
XLogP2.69
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

ethane;ethene;1-(4-methoxyphenyl)piperidine
CID 144518047
1-(4-methoxyphenyl)-4-(2-piperidin-1-ylethyl)piperazine
CID 1439447
1,16-diazatricyclo[14.14.4.231,34]hexatriaconta-31,33,35-triene
CID 177496449
(Z)-3-(4-methoxyphenyl)-3-(4-piperidin-1-ylphenyl)prop-2-enoic acid
CID 21307379
(E)-3-(4-methoxyphenyl)-3-(4-piperidin-1-ylphenyl)prop-2-enoic acid
CID 22731222
2-(4-methoxyphenyl)-1-[4-(4-piperidin-1-ylphenyl)piperazin-1-yl]ethanone
CID 113078995
1-(3-methoxyphenyl)azepane
CID 57276431
3-chloro-4-(4-methoxyphenyl)-1-(4-piperidin-1-ylphenyl)pyrrole-2,5-dione
CID 110583148
1-(4-methoxyphenyl)-4-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperazine
CID 1168311
1-(4-methoxyphenyl)-1,4-diazocan-5-one
CID 117015473
1-[4-(3-methoxyphenyl)phenyl]pyrrolidine
CID 168512705
N-[1-(4-methoxyphenyl)ethyl]-4-piperidin-1-ylbenzamide
CID 43910482

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)piperidine?
The IUPAC name of 1-(4-methoxyphenyl)piperidine (CID 10130315) is 1-(4-methoxyphenyl)piperidine.
What is the SMILES notation for 1-(4-methoxyphenyl)piperidine?
The canonical SMILES for 1-(4-methoxyphenyl)piperidine is COc1ccc(N2CCCCC2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)piperidine?
The InChIKey is PEBHYIWLEXUDPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-14-12-7-5-11(6-8-12)13-9-3-2-4-10-13/h5-8H,2-4,9-10H2,1H3.
What are the key properties of 1-(4-methoxyphenyl)piperidine?
1-(4-methoxyphenyl)piperidine has a molecular weight of 191.27 g/mol, XLogP of 2.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)piperidine is sourced from PubChem (CID 10130315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).