N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide

C24H22N4O2 — CID 121055785

IUPACN-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide
SMILESCc1ccn2cc(-c3ccc(C)c(NC(=O)CNC(=O)c4ccccc4)c3)nc2c1
InChIInChI=1S/C24H22N4O2/c1-16-10-11-28-15-21(26-22(28)12-16)19-9-8-17(2)20(13-19)27-23(29)14-25-24(30)18-6-4-3-5-7-18/h3-13,15H,14H2,1-2H3,(H,25,30)(H,27,29)
InChIKeyZXCBVPIFLVJOBN-UHFFFAOYSA-N
MW398.47 g/mol
LogP3.99
Rot. Bonds5

About N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide

N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide (PubChem CID 121055785) has the molecular formula C24H22N4O2 and a molecular weight of 398.47 g/mol. Its IUPAC name is N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide
PubChem CID121055785
Molecular FormulaC24H22N4O2
Molecular Weight398.47 g/mol
Exact Mass398.17
IUPAC NameN-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide
SMILESCc1ccn2cc(-c3ccc(C)c(NC(=O)CNC(=O)c4ccccc4)c3)nc2c1
InChIInChI=1S/C24H22N4O2/c1-16-10-11-28-15-21(26-22(28)12-16)19-9-8-17(2)20(13-19)27-23(29)14-25-24(30)18-6-4-3-5-7-18/h3-13,15H,14H2,1-2H3,(H,25,30)(H,27,29)
InChIKeyZXCBVPIFLVJOBN-UHFFFAOYSA-N
XLogP3.99
TPSA75.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.47
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide (CID 121055785) is N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide is Cc1ccn2cc(-c3ccc(C)c(NC(=O)CNC(=O)c4ccccc4)c3)nc2c1.
What is the InChIKey of N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide?
The InChIKey is ZXCBVPIFLVJOBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O2/c1-16-10-11-28-15-21(26-22(28)12-16)19-9-8-17(2)20(13-19)27-23(29)14-25-24(30)18-6-4-3-5-7-18/h3-13,15H,14H2,1-2H3,(H,25,30)(H,27,29).
What are the key properties of N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide?
N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide has a molecular weight of 398.47 g/mol, XLogP of 3.99, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide is sourced from PubChem (CID 121055785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).