6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide

C18H14N6O — CID 121114385

IUPAC6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide
SMILESCc1nccn1-c1ccc(C(=O)Nc2cnc3ccccc3c2)nn1
InChIInChI=1S/C18H14N6O/c1-12-19-8-9-24(12)17-7-6-16(22-23-17)18(25)21-14-10-13-4-2-3-5-15(13)20-11-14/h2-11H,1H3,(H,21,25)
InChIKeyYCWUDKCWYXVEDJ-UHFFFAOYSA-N
MW330.35 g/mol
LogP2.77
Rot. Bonds3

About 6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide

6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide (PubChem CID 121114385) has the molecular formula C18H14N6O and a molecular weight of 330.35 g/mol. Its IUPAC name is 6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide
PubChem CID121114385
Molecular FormulaC18H14N6O
Molecular Weight330.35 g/mol
Exact Mass330.12
IUPAC Name6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide
SMILESCc1nccn1-c1ccc(C(=O)Nc2cnc3ccccc3c2)nn1
InChIInChI=1S/C18H14N6O/c1-12-19-8-9-24(12)17-7-6-16(22-23-17)18(25)21-14-10-13-4-2-3-5-15(13)20-11-14/h2-11H,1H3,(H,21,25)
InChIKeyYCWUDKCWYXVEDJ-UHFFFAOYSA-N
XLogP2.77
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.35
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(6-methyl-1,3-benzothiazol-2-yl)-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide
CID 121114367
N-(4-fluoro-3-nitrophenyl)-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide
CID 121114348
4-methyl-N-quinolin-3-ylbenzamide
CID 974969
5-methyl-N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]-1,2-oxazole-3-carboxamide
CID 90565097
N-(5-chloro-2-cyanophenyl)-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide
CID 121114365
5-cyano-N-quinolin-3-ylpyridine-2-carboxamide
CID 63719125
6-amino-N-quinolin-3-ylpyridine-2-carboxamide
CID 62805980
3-chloro-N-quinolin-3-ylbenzamide
CID 3284385
ethyl 6-(quinolin-3-ylcarbamoyl)pyridine-2-carboxylate
CID 4018923
N-[6-(2-methylimidazol-1-yl)-3-pyridinyl]-2-naphthalen-2-yloxyacetamide
CID 90565021
N-[2-(diethylamino)ethyl]-6-(2-methylimidazol-1-yl)pyridazine-3-carboxamide
CID 121114224
2-(4-methylphenyl)-N-quinolin-3-yl-1,3-thiazole-4-carboxamide
CID 22830902

Frequently Asked Questions

What is the IUPAC name of 6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide?
The IUPAC name of 6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide (CID 121114385) is 6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide.
What is the SMILES notation for 6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide?
The canonical SMILES for 6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide is Cc1nccn1-c1ccc(C(=O)Nc2cnc3ccccc3c2)nn1.
What is the InChIKey of 6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide?
The InChIKey is YCWUDKCWYXVEDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N6O/c1-12-19-8-9-24(12)17-7-6-16(22-23-17)18(25)21-14-10-13-4-2-3-5-15(13)20-11-14/h2-11H,1H3,(H,21,25).
What are the key properties of 6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide?
6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide has a molecular weight of 330.35 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylimidazol-1-yl)-N-quinolin-3-ylpyridazine-3-carboxamide is sourced from PubChem (CID 121114385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).