6-methyl-3-piperidin-4-yl-3,4-dihydropyridine

C11H18N2 — CID 69355119

IUPAC6-methyl-3-piperidin-4-yl-3,4-dihydropyridine
SMILESCC1=CCC(C2CCNCC2)C=N1
InChIInChI=1S/C11H18N2/c1-9-2-3-11(8-13-9)10-4-6-12-7-5-10/h2,8,10-12H,3-7H2,1H3
InChIKeyHODDPDWYGNECHA-UHFFFAOYSA-N
MW178.28 g/mol
LogP1.98
Rot. Bonds1

About 6-methyl-3-piperidin-4-yl-3,4-dihydropyridine

6-methyl-3-piperidin-4-yl-3,4-dihydropyridine (PubChem CID 69355119) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 6-methyl-3-piperidin-4-yl-3,4-dihydropyridine.

Molecular Properties

Compound Name6-methyl-3-piperidin-4-yl-3,4-dihydropyridine
PubChem CID69355119
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name6-methyl-3-piperidin-4-yl-3,4-dihydropyridine
SMILESCC1=CCC(C2CCNCC2)C=N1
InChIInChI=1S/C11H18N2/c1-9-2-3-11(8-13-9)10-4-6-12-7-5-10/h2,8,10-12H,3-7H2,1H3
InChIKeyHODDPDWYGNECHA-UHFFFAOYSA-N
XLogP1.98
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-piperidin-4-yl-3,4-dihydropyridine?
The IUPAC name of 6-methyl-3-piperidin-4-yl-3,4-dihydropyridine (CID 69355119) is 6-methyl-3-piperidin-4-yl-3,4-dihydropyridine.
What is the SMILES notation for 6-methyl-3-piperidin-4-yl-3,4-dihydropyridine?
The canonical SMILES for 6-methyl-3-piperidin-4-yl-3,4-dihydropyridine is CC1=CCC(C2CCNCC2)C=N1.
What is the InChIKey of 6-methyl-3-piperidin-4-yl-3,4-dihydropyridine?
The InChIKey is HODDPDWYGNECHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-9-2-3-11(8-13-9)10-4-6-12-7-5-10/h2,8,10-12H,3-7H2,1H3.
What are the key properties of 6-methyl-3-piperidin-4-yl-3,4-dihydropyridine?
6-methyl-3-piperidin-4-yl-3,4-dihydropyridine has a molecular weight of 178.28 g/mol, XLogP of 1.98, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-piperidin-4-yl-3,4-dihydropyridine is sourced from PubChem (CID 69355119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).