N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide

C18H15N5OS — CID 70720614

IUPACN-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(NCCc1csc(-c2cccnc2)n1)c1ccc2nccn2c1
InChIInChI=1S/C18H15N5OS/c24-17(14-3-4-16-20-8-9-23(16)11-14)21-7-5-15-12-25-18(22-15)13-2-1-6-19-10-13/h1-4,6,8-12H,5,7H2,(H,21,24)
InChIKeyPEXWXASRJOXPGE-UHFFFAOYSA-N
MW349.42 g/mol
LogP2.83
Rot. Bonds5

About N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide

N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 70720614) has the molecular formula C18H15N5OS and a molecular weight of 349.42 g/mol. Its IUPAC name is N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID70720614
Molecular FormulaC18H15N5OS
Molecular Weight349.42 g/mol
Exact Mass349.10
IUPAC NameN-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide
SMILESO=C(NCCc1csc(-c2cccnc2)n1)c1ccc2nccn2c1
InChIInChI=1S/C18H15N5OS/c24-17(14-3-4-16-20-8-9-23(16)11-14)21-7-5-15-12-25-18(22-15)13-2-1-6-19-10-13/h1-4,6,8-12H,5,7H2,(H,21,24)
InChIKeyPEXWXASRJOXPGE-UHFFFAOYSA-N
XLogP2.83
TPSA72.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.42
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide (CID 70720614) is N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide is O=C(NCCc1csc(-c2cccnc2)n1)c1ccc2nccn2c1.
What is the InChIKey of N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is PEXWXASRJOXPGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5OS/c24-17(14-3-4-16-20-8-9-23(16)11-14)21-7-5-15-12-25-18(22-15)13-2-1-6-19-10-13/h1-4,6,8-12H,5,7H2,(H,21,24).
What are the key properties of N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide?
N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 349.42 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethyl]imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 70720614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).