1-methyl-N-pyridin-2-ylindazole-6-carboxamide

C14H12N4O — CID 110475569

IUPAC1-methyl-N-pyridin-2-ylindazole-6-carboxamide
SMILESCn1ncc2ccc(C(=O)Nc3ccccn3)cc21
InChIInChI=1S/C14H12N4O/c1-18-12-8-10(5-6-11(12)9-16-18)14(19)17-13-4-2-3-7-15-13/h2-9H,1H3,(H,15,17,19)
InChIKeyNKSFOGQNKRZMTP-UHFFFAOYSA-N
MW252.28 g/mol
LogP2.22
Rot. Bonds2

About 1-methyl-N-pyridin-2-ylindazole-6-carboxamide

1-methyl-N-pyridin-2-ylindazole-6-carboxamide (PubChem CID 110475569) has the molecular formula C14H12N4O and a molecular weight of 252.28 g/mol. Its IUPAC name is 1-methyl-N-pyridin-2-ylindazole-6-carboxamide.

Molecular Properties

Compound Name1-methyl-N-pyridin-2-ylindazole-6-carboxamide
PubChem CID110475569
Molecular FormulaC14H12N4O
Molecular Weight252.28 g/mol
Exact Mass252.10
IUPAC Name1-methyl-N-pyridin-2-ylindazole-6-carboxamide
SMILESCn1ncc2ccc(C(=O)Nc3ccccn3)cc21
InChIInChI=1S/C14H12N4O/c1-18-12-8-10(5-6-11(12)9-16-18)14(19)17-13-4-2-3-7-15-13/h2-9H,1H3,(H,15,17,19)
InChIKeyNKSFOGQNKRZMTP-UHFFFAOYSA-N
XLogP2.22
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-pyridin-2-ylindazole-6-carboxamide?
The IUPAC name of 1-methyl-N-pyridin-2-ylindazole-6-carboxamide (CID 110475569) is 1-methyl-N-pyridin-2-ylindazole-6-carboxamide.
What is the SMILES notation for 1-methyl-N-pyridin-2-ylindazole-6-carboxamide?
The canonical SMILES for 1-methyl-N-pyridin-2-ylindazole-6-carboxamide is Cn1ncc2ccc(C(=O)Nc3ccccn3)cc21.
What is the InChIKey of 1-methyl-N-pyridin-2-ylindazole-6-carboxamide?
The InChIKey is NKSFOGQNKRZMTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O/c1-18-12-8-10(5-6-11(12)9-16-18)14(19)17-13-4-2-3-7-15-13/h2-9H,1H3,(H,15,17,19).
What are the key properties of 1-methyl-N-pyridin-2-ylindazole-6-carboxamide?
1-methyl-N-pyridin-2-ylindazole-6-carboxamide has a molecular weight of 252.28 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-pyridin-2-ylindazole-6-carboxamide is sourced from PubChem (CID 110475569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).