4-(pyridin-3-ylmethyl)piperidin-4-amine

C11H17N3 — CID 86277721

IUPAC4-(pyridin-3-ylmethyl)piperidin-4-amine
SMILESNC1(Cc2cccnc2)CCNCC1
InChIInChI=1S/C11H17N3/c12-11(3-6-13-7-4-11)8-10-2-1-5-14-9-10/h1-2,5,9,13H,3-4,6-8,12H2
InChIKeyHBEXFZKSTOJFHI-UHFFFAOYSA-N
MW191.28 g/mol
LogP0.70
Rot. Bonds2

About 4-(pyridin-3-ylmethyl)piperidin-4-amine

4-(pyridin-3-ylmethyl)piperidin-4-amine (PubChem CID 86277721) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 4-(pyridin-3-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound Name4-(pyridin-3-ylmethyl)piperidin-4-amine
PubChem CID86277721
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name4-(pyridin-3-ylmethyl)piperidin-4-amine
SMILESNC1(Cc2cccnc2)CCNCC1
InChIInChI=1S/C11H17N3/c12-11(3-6-13-7-4-11)8-10-2-1-5-14-9-10/h1-2,5,9,13H,3-4,6-8,12H2
InChIKeyHBEXFZKSTOJFHI-UHFFFAOYSA-N
XLogP0.70
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(pyridin-3-ylmethyl)cyclohexane-1,4-diamine
CID 162146330
2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine
CID 113446872
3-methyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine
CID 104735900
4-amino-4-(pyridin-3-ylmethyl)piperidine-1-carboxylic acid
CID 166652941
3-methyl-1-(pyridin-3-ylmethyl)cyclohexan-1-amine
CID 104735858
[1-(pyridin-3-ylmethyl)cyclopropyl]methanamine;dihydrochloride
CID 86277054
3-[(3-fluoroazetidin-3-yl)methyl]pyridine
CID 104737448
4-tert-butyl-1-(pyridin-3-ylmethyl)cycloheptan-1-amine
CID 104735914
2,2-dimethyl-1-(pyridin-3-ylmethyl)cyclopentan-1-amine
CID 104735918
(4-pyridin-3-ylpiperidin-4-yl)methanamine
CID 80522475
4-[(3-phenylphenyl)methyl]piperidin-4-amine
CID 67531778
1-(pyridin-3-ylmethyl)cyclopropane-1-carbaldehyde
CID 131187567

Frequently Asked Questions

What is the IUPAC name of 4-(pyridin-3-ylmethyl)piperidin-4-amine?
The IUPAC name of 4-(pyridin-3-ylmethyl)piperidin-4-amine (CID 86277721) is 4-(pyridin-3-ylmethyl)piperidin-4-amine.
What is the SMILES notation for 4-(pyridin-3-ylmethyl)piperidin-4-amine?
The canonical SMILES for 4-(pyridin-3-ylmethyl)piperidin-4-amine is NC1(Cc2cccnc2)CCNCC1.
What is the InChIKey of 4-(pyridin-3-ylmethyl)piperidin-4-amine?
The InChIKey is HBEXFZKSTOJFHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c12-11(3-6-13-7-4-11)8-10-2-1-5-14-9-10/h1-2,5,9,13H,3-4,6-8,12H2.
What are the key properties of 4-(pyridin-3-ylmethyl)piperidin-4-amine?
4-(pyridin-3-ylmethyl)piperidin-4-amine has a molecular weight of 191.28 g/mol, XLogP of 0.70, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(pyridin-3-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 86277721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).