2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine

C16H17N5 — CID 162637660

IUPAC2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine
SMILESCn1ccnc1-c1ccc(-c2ccc(CCN)cc2)nn1
InChIInChI=1S/C16H17N5/c1-21-11-10-18-16(21)15-7-6-14(19-20-15)13-4-2-12(3-5-13)8-9-17/h2-7,10-11H,8-9,17H2,1H3
InChIKeyJVRRZFORSUQXDQ-UHFFFAOYSA-N
MW279.35 g/mol
LogP2.05
Rot. Bonds4

About 2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine

2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine (PubChem CID 162637660) has the molecular formula C16H17N5 and a molecular weight of 279.35 g/mol. Its IUPAC name is 2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine.

Molecular Properties

Compound Name2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine
PubChem CID162637660
Molecular FormulaC16H17N5
Molecular Weight279.35 g/mol
Exact Mass279.15
IUPAC Name2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine
SMILESCn1ccnc1-c1ccc(-c2ccc(CCN)cc2)nn1
InChIInChI=1S/C16H17N5/c1-21-11-10-18-16(21)15-7-6-14(19-20-15)13-4-2-12(3-5-13)8-9-17/h2-7,10-11H,8-9,17H2,1H3
InChIKeyJVRRZFORSUQXDQ-UHFFFAOYSA-N
XLogP2.05
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(1-methylimidazol-2-yl)-6-(4-phenoxyphenyl)pyridazine
CID 119066143
1-methyl-2-[4-(1-methylimidazol-2-yl)phenyl]imidazole
CID 1088925
4-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]pyrrolidin-2-one
CID 155911763
1-methyl-2-[4-[4-(1-methylimidazol-2-yl)phenyl]phenyl]imidazole
CID 132575754
2-[4-(2-methylimidazol-1-yl)phenyl]ethanamine
CID 63817285
3-(2-ethoxy-3-pyridinyl)-6-(1-methylimidazol-2-yl)pyridazine
CID 121497129
3-(1-methylimidazol-2-yl)-6-[3-(1H-pyrazol-5-yl)phenyl]pyridazine
CID 77084371
2-[4-(2-methyl-1,2,4-triazol-3-yl)phenyl]ethanamine
CID 62694910
2-[6-(4-ethylphenyl)pyridazin-3-yl]ethanamine
CID 82288033
3-[4-(2-aminoethyl)phenoxy]-1-methylpyrazin-2-one
CID 62938540
2-amino-3-[4-(1-methylimidazol-2-yl)phenyl]propanoic acid
CID 117365060
2-[4-(1-methylimidazol-2-yl)phenyl]acetonitrile
CID 84774362

Frequently Asked Questions

What is the IUPAC name of 2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine?
The IUPAC name of 2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine (CID 162637660) is 2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine.
What is the SMILES notation for 2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine?
The canonical SMILES for 2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine is Cn1ccnc1-c1ccc(-c2ccc(CCN)cc2)nn1.
What is the InChIKey of 2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine?
The InChIKey is JVRRZFORSUQXDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5/c1-21-11-10-18-16(21)15-7-6-14(19-20-15)13-4-2-12(3-5-13)8-9-17/h2-7,10-11H,8-9,17H2,1H3.
What are the key properties of 2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine?
2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine has a molecular weight of 279.35 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[6-(1-methylimidazol-2-yl)pyridazin-3-yl]phenyl]ethanamine is sourced from PubChem (CID 162637660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).