4-[(4-methoxyphenyl)methylidene]piperidine

C13H17NO — CID 20811455

IUPAC4-[(4-methoxyphenyl)methylidene]piperidine
SMILESCOc1ccc(C=C2CCNCC2)cc1
InChIInChI=1S/C13H17NO/c1-15-13-4-2-11(3-5-13)10-12-6-8-14-9-7-12/h2-5,10,14H,6-9H2,1H3
InChIKeyYOZXJVGLHHZSLP-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.46
Rot. Bonds2

About 4-[(4-methoxyphenyl)methylidene]piperidine

4-[(4-methoxyphenyl)methylidene]piperidine (PubChem CID 20811455) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is 4-[(4-methoxyphenyl)methylidene]piperidine.

Molecular Properties

Compound Name4-[(4-methoxyphenyl)methylidene]piperidine
PubChem CID20811455
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name4-[(4-methoxyphenyl)methylidene]piperidine
SMILESCOc1ccc(C=C2CCNCC2)cc1
InChIInChI=1S/C13H17NO/c1-15-13-4-2-11(3-5-13)10-12-6-8-14-9-7-12/h2-5,10,14H,6-9H2,1H3
InChIKeyYOZXJVGLHHZSLP-UHFFFAOYSA-N
XLogP2.46
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-methoxyphenyl)methylidene]piperidine?
The IUPAC name of 4-[(4-methoxyphenyl)methylidene]piperidine (CID 20811455) is 4-[(4-methoxyphenyl)methylidene]piperidine.
What is the SMILES notation for 4-[(4-methoxyphenyl)methylidene]piperidine?
The canonical SMILES for 4-[(4-methoxyphenyl)methylidene]piperidine is COc1ccc(C=C2CCNCC2)cc1.
What is the InChIKey of 4-[(4-methoxyphenyl)methylidene]piperidine?
The InChIKey is YOZXJVGLHHZSLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-15-13-4-2-11(3-5-13)10-12-6-8-14-9-7-12/h2-5,10,14H,6-9H2,1H3.
What are the key properties of 4-[(4-methoxyphenyl)methylidene]piperidine?
4-[(4-methoxyphenyl)methylidene]piperidine has a molecular weight of 203.28 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methoxyphenyl)methylidene]piperidine is sourced from PubChem (CID 20811455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).