5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide

C22H24N8O2 — CID 172718914

IUPAC5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide
SMILESCNC(=O)c1nncc(NC(=O)C2CC2)c1Nc1cccc2c1N(C)Cc1cn(C)nc1-2
InChIInChI=1S/C22H24N8O2/c1-23-22(32)19-18(16(9-24-27-19)26-21(31)12-7-8-12)25-15-6-4-5-14-17-13(11-30(3)28-17)10-29(2)20(14)15/h4-6,9,11-12H,7-8,10H2,1-3H3,(H,23,32)(H,24,25)(H,26,27,31)
InChIKeyGFTKRCPEMSEXOQ-UHFFFAOYSA-N
MW432.49 g/mol
LogP2.28
Rot. Bonds5

About 5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide

5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide (PubChem CID 172718914) has the molecular formula C22H24N8O2 and a molecular weight of 432.49 g/mol. Its IUPAC name is 5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide.

Molecular Properties

Compound Name5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide
PubChem CID172718914
Molecular FormulaC22H24N8O2
Molecular Weight432.49 g/mol
Exact Mass432.20
IUPAC Name5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide
SMILESCNC(=O)c1nncc(NC(=O)C2CC2)c1Nc1cccc2c1N(C)Cc1cn(C)nc1-2
InChIInChI=1S/C22H24N8O2/c1-23-22(32)19-18(16(9-24-27-19)26-21(31)12-7-8-12)25-15-6-4-5-14-17-13(11-30(3)28-17)10-29(2)20(14)15/h4-6,9,11-12H,7-8,10H2,1-3H3,(H,23,32)(H,24,25)(H,26,27,31)
InChIKeyGFTKRCPEMSEXOQ-UHFFFAOYSA-N
XLogP2.28
TPSA117.07 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.49
LogP ≤ 52.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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Related Compounds

6-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide
CID 164944216
6-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridine-3-carboxamide
CID 164903097
6-(cyclopropanecarbonylamino)-4-[[5-methyl-2-(trideuteriomethyl)-4H-pyrazolo[4,3-c][1,6]naphthyridin-6-yl]amino]-N-(trideuteriomethyl)pyridazine-3-carboxamide
CID 164944175
5-(cyclopropanecarbonylamino)-4-[2-methoxy-3-(3-methyl-1,2,4-triazol-1-yl)anilino]-N-(trideuteriomethyl)pyridazine-3-carboxamide
CID 175774164
2-amino-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]pyrimidine-5-carboxylic acid
CID 164944218
6-(cyclopropanecarbonylamino)-4-[(5,5-dideuterio-2,6-dimethylbenzo[h][1,6]naphthyridin-7-yl)amino]-N-(trideuteriomethyl)pyridazine-3-carboxamide
CID 164902722
5-(cyclopropanecarbonylamino)-4-[3-[6-(2-hydroxypropan-2-yl)pyridazin-3-yl]-2-methoxyanilino]-N-(trideuteriomethyl)pyridazine-3-carboxamide
CID 175858731
4-[(4,4-dideuterio-2,5-dimethylpyrazolo[4,3-c]quinolin-6-yl)amino]-N-(trideuteriomethyl)pyridine-3-carboxamide
CID 175976109
6-(cyclopropanecarbonylamino)-4-[(5,5-dideuterio-3-fluoro-6-methylbenzo[h][1,6]naphthyridin-7-yl)amino]-N-(trideuteriomethyl)pyridazine-3-carboxamide
CID 164902747
6-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-triazolo[4,5-c]quinolin-6-yl)amino]-N-(trideuteriomethyl)pyridine-3-carboxamide
CID 164902968
6-(cyclopropanecarbonylamino)-4-[[8-fluoro-5-methyl-2-(trideuteriomethyl)-4H-pyrazolo[4,3-c]quinolin-6-yl]amino]-N-(trideuteriomethyl)pyridine-3-carboxamide
CID 164944400
6-chloro-N-methyl-4-[[5-methyl-3-(oxan-4-yl)-4H-pyrazolo[5,4-c]quinolin-6-yl]amino]pyridazine-3-carboxamide
CID 177347980

Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide?
The IUPAC name of 5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide (CID 172718914) is 5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide.
What is the SMILES notation for 5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide?
The canonical SMILES for 5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide is CNC(=O)c1nncc(NC(=O)C2CC2)c1Nc1cccc2c1N(C)Cc1cn(C)nc1-2.
What is the InChIKey of 5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide?
The InChIKey is GFTKRCPEMSEXOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N8O2/c1-23-22(32)19-18(16(9-24-27-19)26-21(31)12-7-8-12)25-15-6-4-5-14-17-13(11-30(3)28-17)10-29(2)20(14)15/h4-6,9,11-12H,7-8,10H2,1-3H3,(H,23,32)(H,24,25)(H,26,27,31).
What are the key properties of 5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide?
5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide has a molecular weight of 432.49 g/mol, XLogP of 2.28, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropanecarbonylamino)-4-[(2,5-dimethyl-4H-pyrazolo[4,3-c]quinolin-6-yl)amino]-N-methylpyridazine-3-carboxamide is sourced from PubChem (CID 172718914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).