N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide

C18H19N3O — CID 845423

IUPACN-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide
SMILESCC(C)CC(=O)Nc1cccc(-c2cn3ccccc3n2)c1
InChIInChI=1S/C18H19N3O/c1-13(2)10-18(22)19-15-7-5-6-14(11-15)16-12-21-9-4-3-8-17(21)20-16/h3-9,11-13H,10H2,1-2H3,(H,19,22)
InChIKeyCCMKHJVJZUNKRF-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.99
Rot. Bonds4

About N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide

N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide (PubChem CID 845423) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide.

Molecular Properties

Compound NameN-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide
PubChem CID845423
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC NameN-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide
SMILESCC(C)CC(=O)Nc1cccc(-c2cn3ccccc3n2)c1
InChIInChI=1S/C18H19N3O/c1-13(2)10-18(22)19-15-7-5-6-14(11-15)16-12-21-9-4-3-8-17(21)20-16/h3-9,11-13H,10H2,1-2H3,(H,19,22)
InChIKeyCCMKHJVJZUNKRF-UHFFFAOYSA-N
XLogP3.99
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)propanamide
CID 877528
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-2-(4-propan-2-ylsulfonylphenyl)acetamide
CID 122283374
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-2-pyrimidin-2-yloxyacetamide
CID 121086799
2-(benzimidazol-1-yl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)acetamide
CID 121090100
1-(3-fluoro-4-methylphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea
CID 121090060
1-(2,3-dimethoxyphenyl)-3-(3-imidazo[1,2-a]pyridin-2-ylphenyl)urea
CID 122283501
3,4-difluoro-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)benzamide
CID 122283315
(E)-3-(4-chlorophenyl)-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)prop-2-enamide
CID 122283426
2-bromo-N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-5-methoxybenzamide
CID 122283422
N-[4-[(3-imidazo[1,2-a]pyridin-2-ylphenyl)sulfamoyl]-3-methylphenyl]acetamide
CID 122283470
2-(1,3-dioxoisoindol-2-yl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
CID 122284914
2-(3-bromophenyl)imidazo[1,2-a]pyridine;ethane
CID 123472664

Frequently Asked Questions

What is the IUPAC name of N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide?
The IUPAC name of N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide (CID 845423) is N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide.
What is the SMILES notation for N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide?
The canonical SMILES for N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide is CC(C)CC(=O)Nc1cccc(-c2cn3ccccc3n2)c1.
What is the InChIKey of N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide?
The InChIKey is CCMKHJVJZUNKRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-13(2)10-18(22)19-15-7-5-6-14(11-15)16-12-21-9-4-3-8-17(21)20-16/h3-9,11-13H,10H2,1-2H3,(H,19,22).
What are the key properties of N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide?
N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide has a molecular weight of 293.37 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbutanamide is sourced from PubChem (CID 845423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).