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

C19H21N3O2 — CID 59175460

IUPAC4-tert-butyl-N-[6-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide
SMILESCC(C)(C)c1ccc(C(=O)Nc2cn3cc(CO)ccc3n2)cc1
InChIInChI=1S/C19H21N3O2/c1-19(2,3)15-7-5-14(6-8-15)18(24)21-16-11-22-10-13(12-23)4-9-17(22)20-16/h4-11,23H,12H2,1-3H3,(H,21,24)
InChIKeyMICFWOWLBSARJN-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.38
Rot. Bonds3

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

4-tert-butyl-N-[6-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide (PubChem CID 59175460) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is 4-tert-butyl-N-[6-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide.

Molecular Properties

Compound Name4-tert-butyl-N-[6-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide
PubChem CID59175460
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC Name4-tert-butyl-N-[6-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide
SMILESCC(C)(C)c1ccc(C(=O)Nc2cn3cc(CO)ccc3n2)cc1
InChIInChI=1S/C19H21N3O2/c1-19(2,3)15-7-5-14(6-8-15)18(24)21-16-11-22-10-13(12-23)4-9-17(22)20-16/h4-11,23H,12H2,1-3H3,(H,21,24)
InChIKeyMICFWOWLBSARJN-UHFFFAOYSA-N
XLogP3.38
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.38
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-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide?
The IUPAC name of 4-tert-butyl-N-[6-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide (CID 59175460) is 4-tert-butyl-N-[6-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide.
What is the SMILES notation for 4-tert-butyl-N-[6-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide?
The canonical SMILES for 4-tert-butyl-N-[6-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide is CC(C)(C)c1ccc(C(=O)Nc2cn3cc(CO)ccc3n2)cc1.
What is the InChIKey of 4-tert-butyl-N-[6-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide?
The InChIKey is MICFWOWLBSARJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-19(2,3)15-7-5-14(6-8-15)18(24)21-16-11-22-10-13(12-23)4-9-17(22)20-16/h4-11,23H,12H2,1-3H3,(H,21,24).
What are the key properties of 4-tert-butyl-N-[6-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide?
4-tert-butyl-N-[6-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide has a molecular weight of 323.40 g/mol, XLogP of 3.38, 3 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-(hydroxymethyl)imidazo[1,2-a]pyridin-2-yl]benzamide is sourced from PubChem (CID 59175460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).