N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine

C10H12ClN5 — CID 106895595

IUPACN-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine
SMILESCn1c(Cl)cnc1CNCc1cccnn1
InChIInChI=1S/C10H12ClN5/c1-16-9(11)6-13-10(16)7-12-5-8-3-2-4-14-15-8/h2-4,6,12H,5,7H2,1H3
InChIKeyHXGAIRKCTISWLA-UHFFFAOYSA-N
MW237.69 g/mol
LogP1.15
Rot. Bonds4

About N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine

N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine (PubChem CID 106895595) has the molecular formula C10H12ClN5 and a molecular weight of 237.69 g/mol. Its IUPAC name is N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine.

Molecular Properties

Compound NameN-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine
PubChem CID106895595
Molecular FormulaC10H12ClN5
Molecular Weight237.69 g/mol
Exact Mass237.08
IUPAC NameN-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine
SMILESCn1c(Cl)cnc1CNCc1cccnn1
InChIInChI=1S/C10H12ClN5/c1-16-9(11)6-13-10(16)7-12-5-8-3-2-4-14-15-8/h2-4,6,12H,5,7H2,1H3
InChIKeyHXGAIRKCTISWLA-UHFFFAOYSA-N
XLogP1.15
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.69
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-methyl-1,2,4-triazol-3-yl)methyl]-1-pyridazin-3-ylmethanamine
CID 106895919
N-[(1-propylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine
CID 106895060
N-[(1-ethylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine
CID 106834150
N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-(furan-3-yl)methanamine
CID 115607872
N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-(2-pyrazol-1-ylphenyl)methanamine
CID 61166542
N-[(5-chloro-1-methylimidazol-2-yl)methyl]butan-1-amine
CID 43088016
N-[(2,5-dimethylpyrazol-3-yl)methyl]-1-pyridazin-3-ylmethanamine
CID 106895860
N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-[4-(trifluoromethyl)phenyl]methanamine
CID 60702101
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-1-pyridazin-3-ylmethanamine
CID 106895882
N-[(5-chloro-1-methylimidazol-2-yl)methyl]-2-ethylbutan-1-amine
CID 115756655
1-(3-chloro-4-fluorophenyl)-N-[(5-chloro-1-methylimidazol-2-yl)methyl]methanamine
CID 62537628
N-[(4,6-dimethoxypyrimidin-5-yl)methyl]-1-pyridazin-3-ylmethanamine
CID 106895038

Frequently Asked Questions

What is the IUPAC name of N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine?
The IUPAC name of N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine (CID 106895595) is N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine.
What is the SMILES notation for N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine?
The canonical SMILES for N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine is Cn1c(Cl)cnc1CNCc1cccnn1.
What is the InChIKey of N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine?
The InChIKey is HXGAIRKCTISWLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN5/c1-16-9(11)6-13-10(16)7-12-5-8-3-2-4-14-15-8/h2-4,6,12H,5,7H2,1H3.
What are the key properties of N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine?
N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine has a molecular weight of 237.69 g/mol, XLogP of 1.15, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-chloro-1-methylimidazol-2-yl)methyl]-1-pyridazin-3-ylmethanamine is sourced from PubChem (CID 106895595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).