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

C19H21N3O — CID 59175229

IUPAC4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide
SMILESCc1ccc2nc(NC(=O)c3ccc(C(C)(C)C)cc3)cn2c1
InChIInChI=1S/C19H21N3O/c1-13-5-10-17-20-16(12-22(17)11-13)21-18(23)14-6-8-15(9-7-14)19(2,3)4/h5-12H,1-4H3,(H,21,23)
InChIKeyXRDHAJPBGPUPQR-UHFFFAOYSA-N
MW307.40 g/mol
LogP4.19
Rot. Bonds2

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

4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide (PubChem CID 59175229) has the molecular formula C19H21N3O and a molecular weight of 307.40 g/mol. Its IUPAC name is 4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide.

Molecular Properties

Compound Name4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide
PubChem CID59175229
Molecular FormulaC19H21N3O
Molecular Weight307.40 g/mol
Exact Mass307.17
IUPAC Name4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide
SMILESCc1ccc2nc(NC(=O)c3ccc(C(C)(C)C)cc3)cn2c1
InChIInChI=1S/C19H21N3O/c1-13-5-10-17-20-16(12-22(17)11-13)21-18(23)14-6-8-15(9-7-14)19(2,3)4/h5-12H,1-4H3,(H,21,23)
InChIKeyXRDHAJPBGPUPQR-UHFFFAOYSA-N
XLogP4.19
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide?
The IUPAC name of 4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide (CID 59175229) is 4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide.
What is the SMILES notation for 4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide?
The canonical SMILES for 4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide is Cc1ccc2nc(NC(=O)c3ccc(C(C)(C)C)cc3)cn2c1.
What is the InChIKey of 4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide?
The InChIKey is XRDHAJPBGPUPQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O/c1-13-5-10-17-20-16(12-22(17)11-13)21-18(23)14-6-8-15(9-7-14)19(2,3)4/h5-12H,1-4H3,(H,21,23).
What are the key properties of 4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide?
4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide has a molecular weight of 307.40 g/mol, XLogP of 4.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-(6-methylimidazo[1,2-a]pyridin-2-yl)benzamide is sourced from PubChem (CID 59175229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).