1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide

C15H14N4O — CID 110475596

IUPAC1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide
SMILESCn1ncc2ccc(C(=O)NCc3cccnc3)cc21
InChIInChI=1S/C15H14N4O/c1-19-14-7-12(4-5-13(14)10-18-19)15(20)17-9-11-3-2-6-16-8-11/h2-8,10H,9H2,1H3,(H,17,20)
InChIKeyAVRTVLGMFDNULM-UHFFFAOYSA-N
MW266.30 g/mol
LogP1.90
Rot. Bonds3

About 1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide

1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide (PubChem CID 110475596) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is 1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide
PubChem CID110475596
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC Name1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide
SMILESCn1ncc2ccc(C(=O)NCc3cccnc3)cc21
InChIInChI=1S/C15H14N4O/c1-19-14-7-12(4-5-13(14)10-18-19)15(20)17-9-11-3-2-6-16-8-11/h2-8,10H,9H2,1H3,(H,17,20)
InChIKeyAVRTVLGMFDNULM-UHFFFAOYSA-N
XLogP1.90
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 51.90
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-3-ylmethyl)indazole-6-carboxamide?
The IUPAC name of 1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide (CID 110475596) is 1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide.
What is the SMILES notation for 1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide?
The canonical SMILES for 1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide is Cn1ncc2ccc(C(=O)NCc3cccnc3)cc21.
What is the InChIKey of 1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide?
The InChIKey is AVRTVLGMFDNULM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-19-14-7-12(4-5-13(14)10-18-19)15(20)17-9-11-3-2-6-16-8-11/h2-8,10H,9H2,1H3,(H,17,20).
What are the key properties of 1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide?
1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(pyridin-3-ylmethyl)indazole-6-carboxamide is sourced from PubChem (CID 110475596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).