6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one

C17H15N9O — CID 59299244

IUPAC6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one
SMILESCc1cc(Nc2nc(Nc3ccc4c(=O)[nH][nH]c4c3)cc3nccn23)n[nH]1
InChIInChI=1S/C17H15N9O/c1-9-6-14(24-22-9)21-17-20-13(8-15-18-4-5-26(15)17)19-10-2-3-11-12(7-10)23-25-16(11)27/h2-8,19H,1H3,(H2,23,25,27)(H2,20,21,22,24)
InChIKeyOOBANKMYZGMNEZ-UHFFFAOYSA-N
MW361.37 g/mol
LogP2.42
Rot. Bonds4

About 6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one

6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one (PubChem CID 59299244) has the molecular formula C17H15N9O and a molecular weight of 361.37 g/mol. Its IUPAC name is 6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one.

Molecular Properties

Compound Name6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one
PubChem CID59299244
Molecular FormulaC17H15N9O
Molecular Weight361.37 g/mol
Exact Mass361.14
IUPAC Name6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one
SMILESCc1cc(Nc2nc(Nc3ccc4c(=O)[nH][nH]c4c3)cc3nccn23)n[nH]1
InChIInChI=1S/C17H15N9O/c1-9-6-14(24-22-9)21-17-20-13(8-15-18-4-5-26(15)17)19-10-2-3-11-12(7-10)23-25-16(11)27/h2-8,19H,1H3,(H2,23,25,27)(H2,20,21,22,24)
InChIKeyOOBANKMYZGMNEZ-UHFFFAOYSA-N
XLogP2.42
TPSA131.58 Ų
H-Bond Donors5
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.37
LogP ≤ 52.42
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 107

Analyze 6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one with MolForge

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Related Compounds

Pimitespib
CID 67501411
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-{(2S)-1-[(6-fluoropyridin-3-yl)carbonyl]pyrrolidin-2-yl}pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 25101485
Clk1/2-IN-2
CID 59175616
3-methyl-4-{4-[4-(1-methyl-1H-pyrazol-4-yl)-1H-imidazol-1-yl]-3-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridin-1-yl}benzamide
CID 67501021
N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-{(2R)-1-[(6-fluoropyridin-3-yl)carbonyl]pyrrolidin-2-yl}pyrrolo[2,1-f][1,2,4]triazin-4-amine
CID 25101638
4-methyl-N-[3-(4-methylimidazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[4-(1H-pyrazolo[3,4-b]pyridin-5-yl)triazol-1-yl]benzamide
CID 71450038
4-methyl-3-[4-(1H-pyrazolo[3,4-b]pyridin-5-yl)triazol-1-yl]-N-[3-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]benzamide
CID 71455407
4-methyl-N-[3-(3-methyl-1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]-3-[4-(1H-pyrazolo[3,4-b]pyridin-5-yl)triazol-1-yl]benzamide
CID 71459043
N-[4-(diethylaminomethyl)phenyl]-4-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)-1H-pyrazole-5-carboxamide
CID 137653003
3-[7-[4-[(dimethylamino)methyl]pyrazol-1-yl]-1H-imidazo[4,5-b]pyridin-2-yl]-N,1-dimethylindole-5-carboxamide
CID 162654034
N-ethyl-5-methyl-4-[2-methyl-5-[[3-(2-oxopyrrolidin-1-yl)benzoyl]amino]anilino]pyrrolo[2,1-f][1,2,4]triazine-6-carboxamide
CID 44449948
N-ethyl-4-[5-[(3-imidazol-1-ylbenzoyl)amino]-2-methylanilino]-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide
CID 44449949

Frequently Asked Questions

What is the IUPAC name of 6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one?
The IUPAC name of 6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one (CID 59299244) is 6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one.
What is the SMILES notation for 6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one?
The canonical SMILES for 6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one is Cc1cc(Nc2nc(Nc3ccc4c(=O)[nH][nH]c4c3)cc3nccn23)n[nH]1.
What is the InChIKey of 6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one?
The InChIKey is OOBANKMYZGMNEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N9O/c1-9-6-14(24-22-9)21-17-20-13(8-15-18-4-5-26(15)17)19-10-2-3-11-12(7-10)23-25-16(11)27/h2-8,19H,1H3,(H2,23,25,27)(H2,20,21,22,24).
What are the key properties of 6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one?
6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one has a molecular weight of 361.37 g/mol, XLogP of 2.42, 4 rotatable bonds, 5 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]amino]-1,2-dihydroindazol-3-one is sourced from PubChem (CID 59299244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).