N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide

C15H16N6O — CID 135089673

IUPACN-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCn1ncnc1C(NC(=O)c1ccc2nccn2c1)C1CC1
InChIInChI=1S/C15H16N6O/c1-20-14(17-9-18-20)13(10-2-3-10)19-15(22)11-4-5-12-16-6-7-21(12)8-11/h4-10,13H,2-3H2,1H3,(H,19,22)
InChIKeyUNCZCIIGGIGKSP-UHFFFAOYSA-N
MW296.33 g/mol
LogP1.34
Rot. Bonds4

About N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide

N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 135089673) has the molecular formula C15H16N6O and a molecular weight of 296.33 g/mol. Its IUPAC name is N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID135089673
Molecular FormulaC15H16N6O
Molecular Weight296.33 g/mol
Exact Mass296.14
IUPAC NameN-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESCn1ncnc1C(NC(=O)c1ccc2nccn2c1)C1CC1
InChIInChI=1S/C15H16N6O/c1-20-14(17-9-18-20)13(10-2-3-10)19-15(22)11-4-5-12-16-6-7-21(12)8-11/h4-10,13H,2-3H2,1H3,(H,19,22)
InChIKeyUNCZCIIGGIGKSP-UHFFFAOYSA-N
XLogP1.34
TPSA77.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide (CID 135089673) is N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide is Cn1ncnc1C(NC(=O)c1ccc2nccn2c1)C1CC1.
What is the InChIKey of N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is UNCZCIIGGIGKSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N6O/c1-20-14(17-9-18-20)13(10-2-3-10)19-15(22)11-4-5-12-16-6-7-21(12)8-11/h4-10,13H,2-3H2,1H3,(H,19,22).
What are the key properties of N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide?
N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 296.33 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl-(2-methyl-1,2,4-triazol-3-yl)methyl]imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 135089673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).