N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide

C23H21N3O — CID 90570160

IUPACN-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide
SMILESCc1cc(C)cc(C(=O)N(Cc2cnc3ccccn23)c2ccccc2)c1
InChIInChI=1S/C23H21N3O/c1-17-12-18(2)14-19(13-17)23(27)26(20-8-4-3-5-9-20)16-21-15-24-22-10-6-7-11-25(21)22/h3-15H,16H2,1-2H3
InChIKeyIBPCQVGTZIDODM-UHFFFAOYSA-N
MW355.44 g/mol
LogP4.80
Rot. Bonds4

About N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide

N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide (PubChem CID 90570160) has the molecular formula C23H21N3O and a molecular weight of 355.44 g/mol. Its IUPAC name is N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide.

Molecular Properties

Compound NameN-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide
PubChem CID90570160
Molecular FormulaC23H21N3O
Molecular Weight355.44 g/mol
Exact Mass355.17
IUPAC NameN-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide
SMILESCc1cc(C)cc(C(=O)N(Cc2cnc3ccccn23)c2ccccc2)c1
InChIInChI=1S/C23H21N3O/c1-17-12-18(2)14-19(13-17)23(27)26(20-8-4-3-5-9-20)16-21-15-24-22-10-6-7-11-25(21)22/h3-15H,16H2,1-2H3
InChIKeyIBPCQVGTZIDODM-UHFFFAOYSA-N
XLogP4.80
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide?
The IUPAC name of N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide (CID 90570160) is N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide.
What is the SMILES notation for N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide?
The canonical SMILES for N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide is Cc1cc(C)cc(C(=O)N(Cc2cnc3ccccn23)c2ccccc2)c1.
What is the InChIKey of N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide?
The InChIKey is IBPCQVGTZIDODM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3O/c1-17-12-18(2)14-19(13-17)23(27)26(20-8-4-3-5-9-20)16-21-15-24-22-10-6-7-11-25(21)22/h3-15H,16H2,1-2H3.
What are the key properties of N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide?
N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide has a molecular weight of 355.44 g/mol, XLogP of 4.80, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,2-a]pyridin-3-ylmethyl)-3,5-dimethyl-N-phenylbenzamide is sourced from PubChem (CID 90570160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).