2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide

C20H26N4O2S — CID 46943900

IUPAC2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCCc1nc2ccc(C(=O)NCc3cccs3)cn2c1N(CC)CCOC
InChIInChI=1S/C20H26N4O2S/c1-4-17-20(23(5-2)10-11-26-3)24-14-15(8-9-18(24)22-17)19(25)21-13-16-7-6-12-27-16/h6-9,12,14H,4-5,10-11,13H2,1-3H3,(H,21,25)
InChIKeyCVIFAYAXMIRDES-UHFFFAOYSA-N
MW386.52 g/mol
LogP3.36
Rot. Bonds9

About 2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide

2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 46943900) has the molecular formula C20H26N4O2S and a molecular weight of 386.52 g/mol. Its IUPAC name is 2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
PubChem CID46943900
Molecular FormulaC20H26N4O2S
Molecular Weight386.52 g/mol
Exact Mass386.18
IUPAC Name2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide
SMILESCCc1nc2ccc(C(=O)NCc3cccs3)cn2c1N(CC)CCOC
InChIInChI=1S/C20H26N4O2S/c1-4-17-20(23(5-2)10-11-26-3)24-14-15(8-9-18(24)22-17)19(25)21-13-16-7-6-12-27-16/h6-9,12,14H,4-5,10-11,13H2,1-3H3,(H,21,25)
InChIKeyCVIFAYAXMIRDES-UHFFFAOYSA-N
XLogP3.36
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.52
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide (CID 46943900) is 2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide is CCc1nc2ccc(C(=O)NCc3cccs3)cn2c1N(CC)CCOC.
What is the InChIKey of 2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is CVIFAYAXMIRDES-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2S/c1-4-17-20(23(5-2)10-11-26-3)24-14-15(8-9-18(24)22-17)19(25)21-13-16-7-6-12-27-16/h6-9,12,14H,4-5,10-11,13H2,1-3H3,(H,21,25).
What are the key properties of 2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide?
2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 386.52 g/mol, XLogP of 3.36, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-[ethyl(2-methoxyethyl)amino]-N-(thiophen-2-ylmethyl)imidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 46943900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).