1-piperidin-4-yl-3,4-dihydro-2H-pyridine

C10H18N2 — CID 163480110

IUPAC1-piperidin-4-yl-3,4-dihydro-2H-pyridine
SMILESC1=CN(C2CCNCC2)CCC1
InChIInChI=1S/C10H18N2/c1-2-8-12(9-3-1)10-4-6-11-7-5-10/h2,8,10-11H,1,3-7,9H2
InChIKeyCDVFHBPKJYDHPZ-UHFFFAOYSA-N
MW166.27 g/mol
LogP1.35
Rot. Bonds1

About 1-piperidin-4-yl-3,4-dihydro-2H-pyridine

1-piperidin-4-yl-3,4-dihydro-2H-pyridine (PubChem CID 163480110) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 1-piperidin-4-yl-3,4-dihydro-2H-pyridine.

Molecular Properties

Compound Name1-piperidin-4-yl-3,4-dihydro-2H-pyridine
PubChem CID163480110
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name1-piperidin-4-yl-3,4-dihydro-2H-pyridine
SMILESC1=CN(C2CCNCC2)CCC1
InChIInChI=1S/C10H18N2/c1-2-8-12(9-3-1)10-4-6-11-7-5-10/h2,8,10-11H,1,3-7,9H2
InChIKeyCDVFHBPKJYDHPZ-UHFFFAOYSA-N
XLogP1.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1-Piperidino)-1,4-dihydropyridine
CID 129793972
1-[(E)-4-methylpent-1-enyl]piperidin-4-amine;dihydrochloride
CID 18922130
3,4,5,7,8,9,10,10a-Octahydropyrido[1,2-d][1,4]diazepine
CID 19966433
1-(But-3-en-1-yl)piperidin-4-amine
CID 21135899
4-Methylidene-1-piperidin-4-ylpyridine
CID 23534353
1-(4-Methylpent-1-enyl)piperidin-4-amine
CID 57045369
3-Piperidin-1-yl-1,4-dihydropyridine
CID 57140569
1-methyl-N-prop-1-enylpiperidin-4-amine
CID 57636047
5-(3,4-dihydro-2H-pyridin-1-yl)-N-methylpentan-1-amine
CID 58586587
N-but-3-en-2-yl-N-ethylpiperidin-4-amine
CID 62382882
N-but-3-enyl-N-propylpiperidin-4-amine
CID 64313161
N-but-3-enyl-1-methylpiperidin-4-amine
CID 64313269

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-4-yl-3,4-dihydro-2H-pyridine?
The IUPAC name of 1-piperidin-4-yl-3,4-dihydro-2H-pyridine (CID 163480110) is 1-piperidin-4-yl-3,4-dihydro-2H-pyridine.
What is the SMILES notation for 1-piperidin-4-yl-3,4-dihydro-2H-pyridine?
The canonical SMILES for 1-piperidin-4-yl-3,4-dihydro-2H-pyridine is C1=CN(C2CCNCC2)CCC1.
What is the InChIKey of 1-piperidin-4-yl-3,4-dihydro-2H-pyridine?
The InChIKey is CDVFHBPKJYDHPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c1-2-8-12(9-3-1)10-4-6-11-7-5-10/h2,8,10-11H,1,3-7,9H2.
What are the key properties of 1-piperidin-4-yl-3,4-dihydro-2H-pyridine?
1-piperidin-4-yl-3,4-dihydro-2H-pyridine has a molecular weight of 166.27 g/mol, XLogP of 1.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-4-yl-3,4-dihydro-2H-pyridine is sourced from PubChem (CID 163480110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).