4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide

C20H24N4O — CID 59175418

IUPAC4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide
SMILESCNCc1ccc2nc(NC(=O)c3ccc(C(C)(C)C)cc3)cn2c1
InChIInChI=1S/C20H24N4O/c1-20(2,3)16-8-6-15(7-9-16)19(25)23-17-13-24-12-14(11-21-4)5-10-18(24)22-17/h5-10,12-13,21H,11H2,1-4H3,(H,23,25)
InChIKeyCFOTXBVSBAUSMW-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.60
Rot. Bonds4

About 4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide

4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide (PubChem CID 59175418) has the molecular formula C20H24N4O and a molecular weight of 336.44 g/mol. Its IUPAC name is 4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide.

Molecular Properties

Compound Name4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide
PubChem CID59175418
Molecular FormulaC20H24N4O
Molecular Weight336.44 g/mol
Exact Mass336.20
IUPAC Name4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide
SMILESCNCc1ccc2nc(NC(=O)c3ccc(C(C)(C)C)cc3)cn2c1
InChIInChI=1S/C20H24N4O/c1-20(2,3)16-8-6-15(7-9-16)19(25)23-17-13-24-12-14(11-21-4)5-10-18(24)22-17/h5-10,12-13,21H,11H2,1-4H3,(H,23,25)
InChIKeyCFOTXBVSBAUSMW-UHFFFAOYSA-N
XLogP3.60
TPSA58.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide?
The IUPAC name of 4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide (CID 59175418) is 4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide.
What is the SMILES notation for 4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide?
The canonical SMILES for 4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide is CNCc1ccc2nc(NC(=O)c3ccc(C(C)(C)C)cc3)cn2c1.
What is the InChIKey of 4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide?
The InChIKey is CFOTXBVSBAUSMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N4O/c1-20(2,3)16-8-6-15(7-9-16)19(25)23-17-13-24-12-14(11-21-4)5-10-18(24)22-17/h5-10,12-13,21H,11H2,1-4H3,(H,23,25).
What are the key properties of 4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide?
4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide has a molecular weight of 336.44 g/mol, XLogP of 3.60, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-[6-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]benzamide is sourced from PubChem (CID 59175418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).