N-(1-methylindazol-6-yl)pyridine-3-carboxamide

C14H12N4O — CID 110461644

IUPACN-(1-methylindazol-6-yl)pyridine-3-carboxamide
SMILESCn1ncc2ccc(NC(=O)c3cccnc3)cc21
InChIInChI=1S/C14H12N4O/c1-18-13-7-12(5-4-10(13)9-16-18)17-14(19)11-3-2-6-15-8-11/h2-9H,1H3,(H,17,19)
InChIKeyIYZVJWVNQMHGRE-UHFFFAOYSA-N
MW252.28 g/mol
LogP2.22
Rot. Bonds2

About N-(1-methylindazol-6-yl)pyridine-3-carboxamide

N-(1-methylindazol-6-yl)pyridine-3-carboxamide (PubChem CID 110461644) has the molecular formula C14H12N4O and a molecular weight of 252.28 g/mol. Its IUPAC name is N-(1-methylindazol-6-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-methylindazol-6-yl)pyridine-3-carboxamide
PubChem CID110461644
Molecular FormulaC14H12N4O
Molecular Weight252.28 g/mol
Exact Mass252.10
IUPAC NameN-(1-methylindazol-6-yl)pyridine-3-carboxamide
SMILESCn1ncc2ccc(NC(=O)c3cccnc3)cc21
InChIInChI=1S/C14H12N4O/c1-18-13-7-12(5-4-10(13)9-16-18)17-14(19)11-3-2-6-15-8-11/h2-9H,1H3,(H,17,19)
InChIKeyIYZVJWVNQMHGRE-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 N-(1-methylindazol-6-yl)pyridine-3-carboxamide?
The IUPAC name of N-(1-methylindazol-6-yl)pyridine-3-carboxamide (CID 110461644) is N-(1-methylindazol-6-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(1-methylindazol-6-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(1-methylindazol-6-yl)pyridine-3-carboxamide is Cn1ncc2ccc(NC(=O)c3cccnc3)cc21.
What is the InChIKey of N-(1-methylindazol-6-yl)pyridine-3-carboxamide?
The InChIKey is IYZVJWVNQMHGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O/c1-18-13-7-12(5-4-10(13)9-16-18)17-14(19)11-3-2-6-15-8-11/h2-9H,1H3,(H,17,19).
What are the key properties of N-(1-methylindazol-6-yl)pyridine-3-carboxamide?
N-(1-methylindazol-6-yl)pyridine-3-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 N-(1-methylindazol-6-yl)pyridine-3-carboxamide is sourced from PubChem (CID 110461644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).