6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine

C15H17N5S — CID 56756516

IUPAC6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine
SMILESCC(Cc1ccsc1)Nc1ccc(-c2nccn2C)nn1
InChIInChI=1S/C15H17N5S/c1-11(9-12-5-8-21-10-12)17-14-4-3-13(18-19-14)15-16-6-7-20(15)2/h3-8,10-11H,9H2,1-2H3,(H,17,19)
InChIKeyQSSSHVPZIJLNRN-UHFFFAOYSA-N
MW299.40 g/mol
LogP2.98
Rot. Bonds5

About 6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine

6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine (PubChem CID 56756516) has the molecular formula C15H17N5S and a molecular weight of 299.40 g/mol. Its IUPAC name is 6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine.

Molecular Properties

Compound Name6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine
PubChem CID56756516
Molecular FormulaC15H17N5S
Molecular Weight299.40 g/mol
Exact Mass299.12
IUPAC Name6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine
SMILESCC(Cc1ccsc1)Nc1ccc(-c2nccn2C)nn1
InChIInChI=1S/C15H17N5S/c1-11(9-12-5-8-21-10-12)17-14-4-3-13(18-19-14)15-16-6-7-20(15)2/h3-8,10-11H,9H2,1-2H3,(H,17,19)
InChIKeyQSSSHVPZIJLNRN-UHFFFAOYSA-N
XLogP2.98
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.40
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-methyl-3-(1-thiophen-3-ylpropan-2-ylamino)pyrazin-2-one
CID 62938696
5-fluoro-N-(1-thiophen-3-ylpropan-2-yl)pyridin-2-amine
CID 61474267
6-(1-thiophen-3-ylpropan-2-ylamino)pyridine-3-carbonitrile
CID 47357833
(2S)-2-[[2-(1-methylimidazol-2-yl)imidazol-1-yl]methyl]-3-thiophen-3-ylpropan-1-ol
CID 96573733
1-prop-2-enyl-N-(1-thiophen-3-ylpropan-2-yl)imidazol-2-amine
CID 106567886
6-methyl-N-(1-thiophen-3-ylpropan-2-yl)pyridin-3-amine
CID 115921558
1,5-dimethyl-N-(1-thiophen-3-ylpropan-2-yl)pyrazol-4-amine
CID 115923213
N-[1-(3-methylpyrazin-2-yl)ethyl]-1-thiophen-3-ylpropan-2-amine
CID 102612502
6-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridin-2-amine
CID 63588798
2-(furan-2-yl)-1-[(2R)-1-thiophen-3-ylpropan-2-yl]imidazole
CID 95559159
N-(1-benzylcyclopropyl)-6-(1-methylimidazol-2-yl)pyridazin-3-amine
CID 122557581
4-[(1-methylimidazol-2-yl)methoxy]-N-(1-thiophen-3-ylpropan-2-yl)benzamide
CID 55975100

Frequently Asked Questions

What is the IUPAC name of 6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine?
The IUPAC name of 6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine (CID 56756516) is 6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine.
What is the SMILES notation for 6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine?
The canonical SMILES for 6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine is CC(Cc1ccsc1)Nc1ccc(-c2nccn2C)nn1.
What is the InChIKey of 6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine?
The InChIKey is QSSSHVPZIJLNRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5S/c1-11(9-12-5-8-21-10-12)17-14-4-3-13(18-19-14)15-16-6-7-20(15)2/h3-8,10-11H,9H2,1-2H3,(H,17,19).
What are the key properties of 6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine?
6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine has a molecular weight of 299.40 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylimidazol-2-yl)-N-(1-thiophen-3-ylpropan-2-yl)pyridazin-3-amine is sourced from PubChem (CID 56756516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).