4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine

C18H20N2O — CID 66876956

IUPAC4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine
SMILESCc1ccnc(Oc2cccc(C=C3CCNCC3)c2)c1
InChIInChI=1S/C18H20N2O/c1-14-5-10-20-18(11-14)21-17-4-2-3-16(13-17)12-15-6-8-19-9-7-15/h2-5,10-13,19H,6-9H2,1H3
InChIKeySZYYFEGZPCWXPV-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.95
Rot. Bonds3

About 4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine

4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine (PubChem CID 66876956) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine.

Molecular Properties

Compound Name4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine
PubChem CID66876956
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine
SMILESCc1ccnc(Oc2cccc(C=C3CCNCC3)c2)c1
InChIInChI=1S/C18H20N2O/c1-14-5-10-20-18(11-14)21-17-4-2-3-16(13-17)12-15-6-8-19-9-7-15/h2-5,10-13,19H,6-9H2,1H3
InChIKeySZYYFEGZPCWXPV-UHFFFAOYSA-N
XLogP3.95
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine;hydrochloride
CID 66876166
5-bromo-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine
CID 66876144
3-bromo-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine
CID 160748973
3-(piperidin-4-ylidenemethyl)benzaldehyde
CID 165456396
4-[[3-[(5-cyclopropyl-2-pyridinyl)oxy]phenyl]methylidene]cyclohexan-1-one
CID 89463374
tert-butyl 4-[[3-[(5-methyl-2-pyridinyl)oxy]phenyl]methylidene]piperidine-1-carboxylate
CID 68948434
5-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine;4-[[3-[(5-methyl-2-pyridinyl)oxy]phenyl]methylidene]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide;phenyl N-[(1R,2S)-2-phenylcyclopropyl]carbamate
CID 167665991
5-bromo-2-[3-[(3-methylpiperidin-4-ylidene)methyl]phenoxy]pyridine
CID 66884912
benzene;N-cyclopropyl-4-[[3-[(5-methyl-2-pyridinyl)oxy]phenyl]methylidene]piperidine-1-carboxamide;ethane
CID 166076258
N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine
CID 55058261
2-[3-(piperidin-4-ylidenemethyl)phenoxy]-5-(trifluoromethyl)piperidine
CID 162568208
2,2-dimethyl-5-[(3-pyrazin-2-yloxyphenyl)methylidene]-1,3-dioxane-4,6-dione
CID 168598826

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine?
The IUPAC name of 4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine (CID 66876956) is 4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine.
What is the SMILES notation for 4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine?
The canonical SMILES for 4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine is Cc1ccnc(Oc2cccc(C=C3CCNCC3)c2)c1.
What is the InChIKey of 4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine?
The InChIKey is SZYYFEGZPCWXPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-14-5-10-20-18(11-14)21-17-4-2-3-16(13-17)12-15-6-8-19-9-7-15/h2-5,10-13,19H,6-9H2,1H3.
What are the key properties of 4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine?
4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine has a molecular weight of 280.37 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[3-(piperidin-4-ylidenemethyl)phenoxy]pyridine is sourced from PubChem (CID 66876956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).