5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide

C20H19N5O — CID 155482334

IUPAC5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide
SMILESCc1c(C#N)cnc(C(=O)Nc2ccc3n[nH]c(C4(C)CC4)c3c2)c1C
InChIInChI=1S/C20H19N5O/c1-11-12(2)17(22-10-13(11)9-21)19(26)23-14-4-5-16-15(8-14)18(25-24-16)20(3)6-7-20/h4-5,8,10H,6-7H2,1-3H3,(H,23,26)(H,24,25)
InChIKeyGOFBHZRLJBIDOF-UHFFFAOYSA-N
MW345.41 g/mol
LogP3.75
Rot. Bonds3

About 5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide

5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide (PubChem CID 155482334) has the molecular formula C20H19N5O and a molecular weight of 345.41 g/mol. Its IUPAC name is 5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide
PubChem CID155482334
Molecular FormulaC20H19N5O
Molecular Weight345.41 g/mol
Exact Mass345.16
IUPAC Name5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide
SMILESCc1c(C#N)cnc(C(=O)Nc2ccc3n[nH]c(C4(C)CC4)c3c2)c1C
InChIInChI=1S/C20H19N5O/c1-11-12(2)17(22-10-13(11)9-21)19(26)23-14-4-5-16-15(8-14)18(25-24-16)20(3)6-7-20/h4-5,8,10H,6-7H2,1-3H3,(H,23,26)(H,24,25)
InChIKeyGOFBHZRLJBIDOF-UHFFFAOYSA-N
XLogP3.75
TPSA94.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide?
The IUPAC name of 5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide (CID 155482334) is 5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide.
What is the SMILES notation for 5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide?
The canonical SMILES for 5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide is Cc1c(C#N)cnc(C(=O)Nc2ccc3n[nH]c(C4(C)CC4)c3c2)c1C.
What is the InChIKey of 5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide?
The InChIKey is GOFBHZRLJBIDOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O/c1-11-12(2)17(22-10-13(11)9-21)19(26)23-14-4-5-16-15(8-14)18(25-24-16)20(3)6-7-20/h4-5,8,10H,6-7H2,1-3H3,(H,23,26)(H,24,25).
What are the key properties of 5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide?
5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide has a molecular weight of 345.41 g/mol, XLogP of 3.75, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-3,4-dimethyl-N-[3-(1-methylcyclopropyl)-2H-indazol-5-yl]pyridine-2-carboxamide is sourced from PubChem (CID 155482334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).