N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine

C13H12ClN5 — CID 106833996

IUPACN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine
SMILESClc1ccc2nc(CNCc3cccnn3)cn2c1
InChIInChI=1S/C13H12ClN5/c14-10-3-4-13-17-12(9-19(13)8-10)7-15-6-11-2-1-5-16-18-11/h1-5,8-9,15H,6-7H2
InChIKeyJYWISYKYKIBADR-UHFFFAOYSA-N
MW273.73 g/mol
LogP2.07
Rot. Bonds4

About N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine

N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine (PubChem CID 106833996) has the molecular formula C13H12ClN5 and a molecular weight of 273.73 g/mol. Its IUPAC name is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine.

Molecular Properties

Compound NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine
PubChem CID106833996
Molecular FormulaC13H12ClN5
Molecular Weight273.73 g/mol
Exact Mass273.08
IUPAC NameN-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine
SMILESClc1ccc2nc(CNCc3cccnn3)cn2c1
InChIInChI=1S/C13H12ClN5/c14-10-3-4-13-17-12(9-19(13)8-10)7-15-6-11-2-1-5-16-18-11/h1-5,8-9,15H,6-7H2
InChIKeyJYWISYKYKIBADR-UHFFFAOYSA-N
XLogP2.07
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.73
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]propanamide
CID 115345098
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]but-2-yn-1-amine
CID 115866233
2-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]ethylurea
CID 83112157
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]aniline
CID 78912513
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-methyl-2-propan-2-ylbutan-1-amine
CID 102905572
5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentanamide
CID 106237592
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-pyrazol-1-ylpropan-1-amine
CID 115625574
5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol
CID 107303015
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-cyclopropylpropan-1-amine
CID 115639536
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2-methylsulfinylethanamine
CID 115632465
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2-thiophen-2-ylethanamine
CID 78913115
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5,5,5-trifluoropentan-1-amine
CID 115491273

Frequently Asked Questions

What is the IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine?
The IUPAC name of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine (CID 106833996) is N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine.
What is the SMILES notation for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine?
The canonical SMILES for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine is Clc1ccc2nc(CNCc3cccnn3)cn2c1.
What is the InChIKey of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine?
The InChIKey is JYWISYKYKIBADR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClN5/c14-10-3-4-13-17-12(9-19(13)8-10)7-15-6-11-2-1-5-16-18-11/h1-5,8-9,15H,6-7H2.
What are the key properties of N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine?
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine has a molecular weight of 273.73 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-1-pyridazin-3-ylmethanamine is sourced from PubChem (CID 106833996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).