5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide

C20H17N5O — CID 71454887

IUPAC5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide
SMILESCc1cccc(NC(=O)c2nc(C)cc3cc(-c4cccnc4)[nH]c23)n1
InChIInChI=1S/C20H17N5O/c1-12-5-3-7-17(22-12)25-20(26)19-18-15(9-13(2)23-19)10-16(24-18)14-6-4-8-21-11-14/h3-11,24H,1-2H3,(H,22,25,26)
InChIKeyLGVSTMMXQNJXTQ-UHFFFAOYSA-N
MW343.39 g/mol
LogP3.89
Rot. Bonds3

About 5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide

5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide (PubChem CID 71454887) has the molecular formula C20H17N5O and a molecular weight of 343.39 g/mol. Its IUPAC name is 5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide
PubChem CID71454887
Molecular FormulaC20H17N5O
Molecular Weight343.39 g/mol
Exact Mass343.14
IUPAC Name5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide
SMILESCc1cccc(NC(=O)c2nc(C)cc3cc(-c4cccnc4)[nH]c23)n1
InChIInChI=1S/C20H17N5O/c1-12-5-3-7-17(22-12)25-20(26)19-18-15(9-13(2)23-19)10-16(24-18)14-6-4-8-21-11-14/h3-11,24H,1-2H3,(H,22,25,26)
InChIKeyLGVSTMMXQNJXTQ-UHFFFAOYSA-N
XLogP3.89
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide?
The IUPAC name of 5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide (CID 71454887) is 5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide.
What is the SMILES notation for 5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide?
The canonical SMILES for 5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide is Cc1cccc(NC(=O)c2nc(C)cc3cc(-c4cccnc4)[nH]c23)n1.
What is the InChIKey of 5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide?
The InChIKey is LGVSTMMXQNJXTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5O/c1-12-5-3-7-17(22-12)25-20(26)19-18-15(9-13(2)23-19)10-16(24-18)14-6-4-8-21-11-14/h3-11,24H,1-2H3,(H,22,25,26).
What are the key properties of 5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide?
5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide has a molecular weight of 343.39 g/mol, XLogP of 3.89, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(6-methyl-2-pyridinyl)-2-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine-7-carboxamide is sourced from PubChem (CID 71454887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).