8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide

C13H17N3O — CID 166563382

IUPAC8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(C(C)(C)C)c2ncc(C(N)=O)n12
InChIInChI=1S/C13H17N3O/c1-8-5-6-9(13(2,3)4)12-15-7-10(11(14)17)16(8)12/h5-7H,1-4H3,(H2,14,17)
InChIKeyVKFIADAJAXPXOV-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.04
Rot. Bonds1

About 8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide

8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 166563382) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is 8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID166563382
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(C(C)(C)C)c2ncc(C(N)=O)n12
InChIInChI=1S/C13H17N3O/c1-8-5-6-9(13(2,3)4)12-15-7-10(11(14)17)16(8)12/h5-7H,1-4H3,(H2,14,17)
InChIKeyVKFIADAJAXPXOV-UHFFFAOYSA-N
XLogP2.04
TPSA60.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-tert-butyl-5-methyl-3-methylsulfonylimidazo[1,2-a]pyridine
CID 166563357
8-tert-butyl-3-fluoro-5-methylimidazo[1,2-a]pyridine
CID 166563481
ethyl 8-tert-butylimidazo[1,2-a]pyridine-3-carboxylate
CID 166563440
8-tert-butylimidazo[1,2-a]pyridine-3-carboxylic acid
CID 166563458
3-(2-hydroxypropan-2-yl)imidazole-4-carboxamide
CID 23221887
3-tert-butyl-2-fluoro-6-methylbenzamide
CID 122604245
4-tert-butyl-1,2-oxazole-5-carboxamide
CID 162696866
8-tert-butyl-2,5,11-triazatricyclo[5.3.1.04,11]undeca-1(10),4,6,8-tetraen-3-one
CID 176640686
8-tert-butyl-6-fluoro-N,N-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 166563348
8-bromo-5-methylimidazo[1,2-a]pyridin-3-amine
CID 130065386
6-tert-butylpyridine-3-carboxamide;ethane
CID 144695705
1-methylpyrrole-2,5-dicarboxamide
CID 141229760

Frequently Asked Questions

What is the IUPAC name of 8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 166563382) is 8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide is Cc1ccc(C(C)(C)C)c2ncc(C(N)=O)n12.
What is the InChIKey of 8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is VKFIADAJAXPXOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-8-5-6-9(13(2,3)4)12-15-7-10(11(14)17)16(8)12/h5-7H,1-4H3,(H2,14,17).
What are the key properties of 8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide?
8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 231.30 g/mol, XLogP of 2.04, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-tert-butyl-5-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 166563382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).