1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide

C19H15N7O2 — CID 155129008

IUPAC1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide
SMILESCc1c(C(=O)Nc2ccc3[nH]nc(-c4cnco4)c3c2)ncc2c1cnn2C
InChIInChI=1S/C19H15N7O2/c1-10-13-6-22-26(2)15(13)7-21-17(10)19(27)23-11-3-4-14-12(5-11)18(25-24-14)16-8-20-9-28-16/h3-9H,1-2H3,(H,23,27)(H,24,25)
InChIKeyTUTHCCQSWYQHJU-UHFFFAOYSA-N
MW373.38 g/mol
LogP3.06
Rot. Bonds3

About 1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide

1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide (PubChem CID 155129008) has the molecular formula C19H15N7O2 and a molecular weight of 373.38 g/mol. Its IUPAC name is 1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide.

Molecular Properties

Compound Name1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide
PubChem CID155129008
Molecular FormulaC19H15N7O2
Molecular Weight373.38 g/mol
Exact Mass373.13
IUPAC Name1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide
SMILESCc1c(C(=O)Nc2ccc3[nH]nc(-c4cnco4)c3c2)ncc2c1cnn2C
InChIInChI=1S/C19H15N7O2/c1-10-13-6-22-26(2)15(13)7-21-17(10)19(27)23-11-3-4-14-12(5-11)18(25-24-14)16-8-20-9-28-16/h3-9H,1-2H3,(H,23,27)(H,24,25)
InChIKeyTUTHCCQSWYQHJU-UHFFFAOYSA-N
XLogP3.06
TPSA114.52 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.38
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide?
The IUPAC name of 1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide (CID 155129008) is 1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide.
What is the SMILES notation for 1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide?
The canonical SMILES for 1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide is Cc1c(C(=O)Nc2ccc3[nH]nc(-c4cnco4)c3c2)ncc2c1cnn2C.
What is the InChIKey of 1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide?
The InChIKey is TUTHCCQSWYQHJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N7O2/c1-10-13-6-22-26(2)15(13)7-21-17(10)19(27)23-11-3-4-14-12(5-11)18(25-24-14)16-8-20-9-28-16/h3-9H,1-2H3,(H,23,27)(H,24,25).
What are the key properties of 1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide?
1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide has a molecular weight of 373.38 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-N-[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]pyrazolo[3,4-c]pyridine-5-carboxamide is sourced from PubChem (CID 155129008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).