N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide

C14H12N4O2 — CID 40711278

IUPACN-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide
SMILESCOc1ccc(NC(=O)c2n[nH]c3ccccc23)cn1
InChIInChI=1S/C14H12N4O2/c1-20-12-7-6-9(8-15-12)16-14(19)13-10-4-2-3-5-11(10)17-18-13/h2-8H,1H3,(H,16,19)(H,17,18)
InChIKeyPXCVEBTZLGXKLD-UHFFFAOYSA-N
MW268.28 g/mol
LogP2.22
Rot. Bonds3

About N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide

N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide (PubChem CID 40711278) has the molecular formula C14H12N4O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide
PubChem CID40711278
Molecular FormulaC14H12N4O2
Molecular Weight268.28 g/mol
Exact Mass268.10
IUPAC NameN-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide
SMILESCOc1ccc(NC(=O)c2n[nH]c3ccccc23)cn1
InChIInChI=1S/C14H12N4O2/c1-20-12-7-6-9(8-15-12)16-14(19)13-10-4-2-3-5-11(10)17-18-13/h2-8H,1H3,(H,16,19)(H,17,18)
InChIKeyPXCVEBTZLGXKLD-UHFFFAOYSA-N
XLogP2.22
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide?
The IUPAC name of N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide (CID 40711278) is N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide is COc1ccc(NC(=O)c2n[nH]c3ccccc23)cn1.
What is the InChIKey of N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide?
The InChIKey is PXCVEBTZLGXKLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O2/c1-20-12-7-6-9(8-15-12)16-14(19)13-10-4-2-3-5-11(10)17-18-13/h2-8H,1H3,(H,16,19)(H,17,18).
What are the key properties of N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide?
N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide has a molecular weight of 268.28 g/mol, XLogP of 2.22, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-3-pyridinyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 40711278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).