2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide

C24H26N4O2 — CID 68770071

IUPAC2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1c(N(C)C(=O)c2ccccc2)nc2n1CCCC2
InChIInChI=1S/C24H26N4O2/c1-26(17-18-11-5-3-6-12-18)24(30)21-22(25-20-15-9-10-16-28(20)21)27(2)23(29)19-13-7-4-8-14-19/h3-8,11-14H,9-10,15-17H2,1-2H3
InChIKeyYXFYXYDVZSDNRU-UHFFFAOYSA-N
MW402.50 g/mol
LogP3.77
Rot. Bonds5

About 2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide

2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 68770071) has the molecular formula C24H26N4O2 and a molecular weight of 402.50 g/mol. Its IUPAC name is 2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID68770071
Molecular FormulaC24H26N4O2
Molecular Weight402.50 g/mol
Exact Mass402.21
IUPAC Name2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide
SMILESCN(Cc1ccccc1)C(=O)c1c(N(C)C(=O)c2ccccc2)nc2n1CCCC2
InChIInChI=1S/C24H26N4O2/c1-26(17-18-11-5-3-6-12-18)24(30)21-22(25-20-15-9-10-16-28(20)21)27(2)23(29)19-13-7-4-8-14-19/h3-8,11-14H,9-10,15-17H2,1-2H3
InChIKeyYXFYXYDVZSDNRU-UHFFFAOYSA-N
XLogP3.77
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.50
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide (CID 68770071) is 2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide is CN(Cc1ccccc1)C(=O)c1c(N(C)C(=O)c2ccccc2)nc2n1CCCC2.
What is the InChIKey of 2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is YXFYXYDVZSDNRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O2/c1-26(17-18-11-5-3-6-12-18)24(30)21-22(25-20-15-9-10-16-28(20)21)27(2)23(29)19-13-7-4-8-14-19/h3-8,11-14H,9-10,15-17H2,1-2H3.
What are the key properties of 2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide?
2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 402.50 g/mol, XLogP of 3.77, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzoyl(methyl)amino]-N-benzyl-N-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 68770071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).