2-methyl-5-piperidin-4-yl-2,3-dihydropyridine

C11H18N2 — CID 123831605

IUPAC2-methyl-5-piperidin-4-yl-2,3-dihydropyridine
SMILESCC1CC=C(C2CCNCC2)C=N1
InChIInChI=1S/C11H18N2/c1-9-2-3-11(8-13-9)10-4-6-12-7-5-10/h3,8-10,12H,2,4-7H2,1H3
InChIKeyDDMBHDRDMWWOBS-UHFFFAOYSA-N
MW178.28 g/mol
LogP1.78
Rot. Bonds1

About 2-methyl-5-piperidin-4-yl-2,3-dihydropyridine

2-methyl-5-piperidin-4-yl-2,3-dihydropyridine (PubChem CID 123831605) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 2-methyl-5-piperidin-4-yl-2,3-dihydropyridine.

Molecular Properties

Compound Name2-methyl-5-piperidin-4-yl-2,3-dihydropyridine
PubChem CID123831605
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name2-methyl-5-piperidin-4-yl-2,3-dihydropyridine
SMILESCC1CC=C(C2CCNCC2)C=N1
InChIInChI=1S/C11H18N2/c1-9-2-3-11(8-13-9)10-4-6-12-7-5-10/h3,8-10,12H,2,4-7H2,1H3
InChIKeyDDMBHDRDMWWOBS-UHFFFAOYSA-N
XLogP1.78
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 ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(5-methyl-2H-pyrrol-3-yl)piperidine
CID 58578256
N-[(2-methyl-2,3-dihydropyridin-4-yl)methyl]ethanamine
CID 89030889
(2S)-2-(2-methyl-2H-pyrrol-4-yl)piperidine
CID 89154206
1,2,3,4,4a,5-Hexahydro-2,6-naphthyridine
CID 90698342
4-(2,3-Dimethyl-2,3-dihydropyrrol-4-ylidene)piperidine
CID 90762439
(2E)-4-methyl-2-piperidin-3-ylidene-4,5-dihydro-3H-pyridine
CID 90918902
5-Methyl-3-(piperidin-4-ylmethyl)-2,3-dihydropyridine
CID 91459524
(E)-4-piperidin-4-ylpent-3-en-2-imine
CID 123268672
2-ethenyl-N-(piperidin-4-ylmethyl)hexa-2,4-dien-1-imine
CID 123822692
N,3,6,7-tetramethyl-5-(methyliminomethyl)octa-4,7-dien-2-amine
CID 123919390
(Z)-N-methyl-3-(4-methylcyclohexen-1-yl)-2-piperidin-4-ylprop-2-en-1-imine
CID 126517181
(Z)-2-methyl-N-(1-piperidin-4-ylbutan-2-yl)but-2-en-1-imine
CID 130242041

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-piperidin-4-yl-2,3-dihydropyridine?
The IUPAC name of 2-methyl-5-piperidin-4-yl-2,3-dihydropyridine (CID 123831605) is 2-methyl-5-piperidin-4-yl-2,3-dihydropyridine.
What is the SMILES notation for 2-methyl-5-piperidin-4-yl-2,3-dihydropyridine?
The canonical SMILES for 2-methyl-5-piperidin-4-yl-2,3-dihydropyridine is CC1CC=C(C2CCNCC2)C=N1.
What is the InChIKey of 2-methyl-5-piperidin-4-yl-2,3-dihydropyridine?
The InChIKey is DDMBHDRDMWWOBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-9-2-3-11(8-13-9)10-4-6-12-7-5-10/h3,8-10,12H,2,4-7H2,1H3.
What are the key properties of 2-methyl-5-piperidin-4-yl-2,3-dihydropyridine?
2-methyl-5-piperidin-4-yl-2,3-dihydropyridine has a molecular weight of 178.28 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-piperidin-4-yl-2,3-dihydropyridine is sourced from PubChem (CID 123831605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).