4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine

C14H26N2 — CID 114410854

IUPAC4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine
SMILESCC1=CCN(CCCC2CCNCC2)CC1
InChIInChI=1S/C14H26N2/c1-13-6-11-16(12-7-13)10-2-3-14-4-8-15-9-5-14/h6,14-15H,2-5,7-12H2,1H3
InChIKeyGGWMTYAPDRHKJV-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.42
Rot. Bonds4

About 4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine

4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine (PubChem CID 114410854) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is 4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine
PubChem CID114410854
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine
SMILESCC1=CCN(CCCC2CCNCC2)CC1
InChIInChI=1S/C14H26N2/c1-13-6-11-16(12-7-13)10-2-3-14-4-8-15-9-5-14/h6,14-15H,2-5,7-12H2,1H3
InChIKeyGGWMTYAPDRHKJV-UHFFFAOYSA-N
XLogP2.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

4-(methoxymethyl)-1-(3-pyrrolidin-3-ylpropyl)-3,6-dihydro-2H-pyridine
CID 114411004
1-[2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethyl]-1,4-diazepane
CID 114410727
1-methyl-4-(3-piperidin-4-ylpropyl)piperazine
CID 15057324
N-(cyclopropylmethyl)-2-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)ethanamine
CID 104694198
1-cyclopropyl-4-(3-piperidin-4-ylpropyl)piperazine
CID 62212520
1-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-3-pyrrolidin-3-ylpropan-1-one
CID 114409316
4-[3-(2,5-dimethyl-1,2-dihydroimidazol-3-yl)propyl]piperidine
CID 142002089
4-[3-(4-methylimidazol-1-yl)propyl]piperidine
CID 22662903
4-[3-(3-methoxypyrrolidin-1-yl)propyl]piperidine
CID 103534757
1-(3-pyrrolidin-3-ylpropyl)piperidine
CID 54342662
4-(2,3-dichlorophenyl)-1-(2-piperidin-4-ylethyl)-3,6-dihydro-2H-pyridine
CID 141198643
2-methyl-1-(3-piperidin-4-ylpropyl)-3,4-dihydro-2H-quinoline
CID 62211993

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine?
The IUPAC name of 4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine (CID 114410854) is 4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine?
The canonical SMILES for 4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine is CC1=CCN(CCCC2CCNCC2)CC1.
What is the InChIKey of 4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine?
The InChIKey is GGWMTYAPDRHKJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-13-6-11-16(12-7-13)10-2-3-14-4-8-15-9-5-14/h6,14-15H,2-5,7-12H2,1H3.
What are the key properties of 4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine?
4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine has a molecular weight of 222.38 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 114410854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).