1-(piperidin-4-ylmethyl)-2H-pyridine

C11H18N2 — CID 141002026

IUPAC1-(piperidin-4-ylmethyl)-2H-pyridine
SMILESC1=CCN(CC2CCNCC2)C=C1
InChIInChI=1S/C11H18N2/c1-2-8-13(9-3-1)10-11-4-6-12-7-5-11/h1-3,8,11-12H,4-7,9-10H2
InChIKeyAGVYAVRQQOSQFS-UHFFFAOYSA-N
MW178.28 g/mol
LogP1.37
Rot. Bonds2

About 1-(piperidin-4-ylmethyl)-2H-pyridine

1-(piperidin-4-ylmethyl)-2H-pyridine (PubChem CID 141002026) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 1-(piperidin-4-ylmethyl)-2H-pyridine.

Molecular Properties

Compound Name1-(piperidin-4-ylmethyl)-2H-pyridine
PubChem CID141002026
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name1-(piperidin-4-ylmethyl)-2H-pyridine
SMILESC1=CCN(CC2CCNCC2)C=C1
InChIInChI=1S/C11H18N2/c1-2-8-13(9-3-1)10-11-4-6-12-7-5-11/h1-3,8,11-12H,4-7,9-10H2
InChIKeyAGVYAVRQQOSQFS-UHFFFAOYSA-N
XLogP1.37
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Octahydro 4,4'-bipyridyl
CID 4867470
N,N-Di-2-propen-1-yl-4-piperidinemethanamine
CID 16768074
1-piperidin-4-yl-2H-pyridin-4-amine
CID 19068126
2-Piperidin-1-yl-1,2-dihydropyridine
CID 21878399
Diallyl-(2-piperidin-4-yl-ethyl)-amine
CID 22309090
4-(Piperidin-1-ylmethyl)-1,2-dihydropyridine
CID 23166923
2-(2-piperidin-4-ylethyl)-6H-pyrrolo[1,2-a]pyrazine
CID 54124043
N-ethyl-3-(4-methylpiperidin-1-yl)prop-1-en-1-amine
CID 68354216
1-piperidin-2-yl-2H-pyridine
CID 69375797
4-Piperidin-1-yl-1,2-dihydropyridine
CID 86340256
(1Z,3E)-3-[4-(aminomethyl)piperidin-1-yl]hexa-1,3,5-trien-1-amine
CID 88978669
(1Z,3E)-3-(3,9-diazaspiro[5.5]undecan-3-yl)hexa-1,3,5-trien-1-amine
CID 89034874

Frequently Asked Questions

What is the IUPAC name of 1-(piperidin-4-ylmethyl)-2H-pyridine?
The IUPAC name of 1-(piperidin-4-ylmethyl)-2H-pyridine (CID 141002026) is 1-(piperidin-4-ylmethyl)-2H-pyridine.
What is the SMILES notation for 1-(piperidin-4-ylmethyl)-2H-pyridine?
The canonical SMILES for 1-(piperidin-4-ylmethyl)-2H-pyridine is C1=CCN(CC2CCNCC2)C=C1.
What is the InChIKey of 1-(piperidin-4-ylmethyl)-2H-pyridine?
The InChIKey is AGVYAVRQQOSQFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-2-8-13(9-3-1)10-11-4-6-12-7-5-11/h1-3,8,11-12H,4-7,9-10H2.
What are the key properties of 1-(piperidin-4-ylmethyl)-2H-pyridine?
1-(piperidin-4-ylmethyl)-2H-pyridine has a molecular weight of 178.28 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(piperidin-4-ylmethyl)-2H-pyridine is sourced from PubChem (CID 141002026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).