1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide

C14H10N6O — CID 5331049

IUPAC1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide
SMILESNC(=O)c1[nH]n(-c2ccccn2)c2c1ccc1nncc12
InChIInChI=1S/C14H10N6O/c15-14(21)12-8-4-5-10-9(7-17-18-10)13(8)20(19-12)11-3-1-2-6-16-11/h1-7,19H,(H2,15,21)
InChIKeyOEIFIOFIEOFOOQ-UHFFFAOYSA-N
MW278.28 g/mol
LogP1.40
Rot. Bonds2

About 1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide

1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide (PubChem CID 5331049) has the molecular formula C14H10N6O and a molecular weight of 278.28 g/mol. Its IUPAC name is 1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide.

Molecular Properties

Compound Name1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide
PubChem CID5331049
Molecular FormulaC14H10N6O
Molecular Weight278.28 g/mol
Exact Mass278.09
IUPAC Name1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide
SMILESNC(=O)c1[nH]n(-c2ccccn2)c2c1ccc1nncc12
InChIInChI=1S/C14H10N6O/c15-14(21)12-8-4-5-10-9(7-17-18-10)13(8)20(19-12)11-3-1-2-6-16-11/h1-7,19H,(H2,15,21)
InChIKeyOEIFIOFIEOFOOQ-UHFFFAOYSA-N
XLogP1.40
TPSA102.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.28
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide?
The IUPAC name of 1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide (CID 5331049) is 1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide.
What is the SMILES notation for 1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide?
The canonical SMILES for 1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide is NC(=O)c1[nH]n(-c2ccccn2)c2c1ccc1nncc12.
What is the InChIKey of 1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide?
The InChIKey is OEIFIOFIEOFOOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N6O/c15-14(21)12-8-4-5-10-9(7-17-18-10)13(8)20(19-12)11-3-1-2-6-16-11/h1-7,19H,(H2,15,21).
What are the key properties of 1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide?
1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide has a molecular weight of 278.28 g/mol, XLogP of 1.40, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyridin-2-yl-2H-pyrazolo[3,4-e]indazole-3-carboxamide is sourced from PubChem (CID 5331049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).