N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine

C15H19N5 — CID 116971115

IUPACN-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine
SMILESc1ccc(-c2ccc(NCC3CCCNC3)nn2)nc1
InChIInChI=1S/C15H19N5/c1-2-9-17-13(5-1)14-6-7-15(20-19-14)18-11-12-4-3-8-16-10-12/h1-2,5-7,9,12,16H,3-4,8,10-11H2,(H,18,20)
InChIKeyIMROODCAOSQTGJ-UHFFFAOYSA-N
MW269.35 g/mol
LogP1.95
Rot. Bonds4

About N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine

N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine (PubChem CID 116971115) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine.

Molecular Properties

Compound NameN-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine
PubChem CID116971115
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC NameN-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine
SMILESc1ccc(-c2ccc(NCC3CCCNC3)nn2)nc1
InChIInChI=1S/C15H19N5/c1-2-9-17-13(5-1)14-6-7-15(20-19-14)18-11-12-4-3-8-16-10-12/h1-2,5-7,9,12,16H,3-4,8,10-11H2,(H,18,20)
InChIKeyIMROODCAOSQTGJ-UHFFFAOYSA-N
XLogP1.95
TPSA62.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-phenyl-N-(piperidin-3-ylmethyl)pyridazin-3-amine
CID 116971112
6-cyclobutyl-N-(pyrrolidin-3-ylmethyl)pyridazin-3-amine
CID 116971097
2-(piperidin-3-ylmethyl)-4-pyridin-2-ylpyrimidine
CID 116898975
3-piperidin-3-yloxy-6-pyridin-2-ylpyridazine
CID 130229783
2-[2-[(3R)-piperidin-3-yl]ethoxy]pyridine
CID 94409716
6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
CID 96586619
N-(piperidin-3-ylmethyl)quinolin-8-amine
CID 80553061
2-methylsulfanyl-N-[[(3R)-piperidin-3-yl]methyl]pyrimidin-4-amine
CID 97165005
N-(piperidin-3-ylmethyl)quinolin-5-amine
CID 80552964
N-(piperidin-3-ylmethyl)-1-pyridin-2-ylethanesulfonamide;hydrochloride
CID 71637453
2-methylsulfanyl-N-(piperidin-3-ylmethyl)aniline
CID 80553558
N-[(2-methyl-1,3-dihydroisoindol-1-yl)methyl]-6-pyridin-2-ylpyridazin-3-amine
CID 166363589

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine?
The IUPAC name of N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine (CID 116971115) is N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine.
What is the SMILES notation for N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine?
The canonical SMILES for N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine is c1ccc(-c2ccc(NCC3CCCNC3)nn2)nc1.
What is the InChIKey of N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine?
The InChIKey is IMROODCAOSQTGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c1-2-9-17-13(5-1)14-6-7-15(20-19-14)18-11-12-4-3-8-16-10-12/h1-2,5-7,9,12,16H,3-4,8,10-11H2,(H,18,20).
What are the key properties of N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine?
N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine has a molecular weight of 269.35 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-3-ylmethyl)-6-pyridin-2-ylpyridazin-3-amine is sourced from PubChem (CID 116971115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).