4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine

C10H11N5 — CID 175978726

IUPAC4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine
SMILESNc1cnnc(N)c1Cc1ccccn1
InChIInChI=1S/C10H11N5/c11-9-6-14-15-10(12)8(9)5-7-3-1-2-4-13-7/h1-4,6H,5H2,(H4,11,12,15)
InChIKeyCKLUWFGJOROKSM-UHFFFAOYSA-N
MW201.23 g/mol
LogP0.63
Rot. Bonds2

About 4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine

4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine (PubChem CID 175978726) has the molecular formula C10H11N5 and a molecular weight of 201.23 g/mol. Its IUPAC name is 4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine.

Molecular Properties

Compound Name4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine
PubChem CID175978726
Molecular FormulaC10H11N5
Molecular Weight201.23 g/mol
Exact Mass201.10
IUPAC Name4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine
SMILESNc1cnnc(N)c1Cc1ccccn1
InChIInChI=1S/C10H11N5/c11-9-6-14-15-10(12)8(9)5-7-3-1-2-4-13-7/h1-4,6H,5H2,(H4,11,12,15)
InChIKeyCKLUWFGJOROKSM-UHFFFAOYSA-N
XLogP0.63
TPSA90.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(aminomethyl)-2,3-bis(pyridin-2-ylmethyl)phenyl]methanamine
CID 68592017
5-methyl-2-(pyridin-2-ylmethyl)-1,3-thiazol-4-amine
CID 83107325
benzene-1,2-diamine;2-(pyridin-2-ylmethyl)phenol
CID 175372198
2-[[3,5-bis(pyridin-2-ylmethyl)phenyl]methyl]pyridine
CID 102075718
4-chloro-2-(pyridin-2-ylmethyl)aniline
CID 14005180
5-chloro-6-[4-(pyridin-2-ylmethyl)piperazin-1-yl]pyridazin-4-amine
CID 71850443
3,6-bis(2-pyridin-2-ylethyl)-1,2,4,5-tetrazine
CID 162747198
ethane;pyridin-2-ylmethanamine
CID 90791011
2-(14-pyridin-2-yltetradecyl)pyridine
CID 10594187
4-(2-pyridin-2-ylethyl)benzene-1,2-diamine
CID 10398308
2-(2-pyridin-2-ylethylsulfanyl)aniline
CID 12029846
N'-(pyridin-2-ylmethyl)-2-sulfanylethanimidamide
CID 90668643

Frequently Asked Questions

What is the IUPAC name of 4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine?
The IUPAC name of 4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine (CID 175978726) is 4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine.
What is the SMILES notation for 4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine?
The canonical SMILES for 4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine is Nc1cnnc(N)c1Cc1ccccn1.
What is the InChIKey of 4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine?
The InChIKey is CKLUWFGJOROKSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5/c11-9-6-14-15-10(12)8(9)5-7-3-1-2-4-13-7/h1-4,6H,5H2,(H4,11,12,15).
What are the key properties of 4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine?
4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine has a molecular weight of 201.23 g/mol, XLogP of 0.63, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(pyridin-2-ylmethyl)pyridazine-3,5-diamine is sourced from PubChem (CID 175978726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).