N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide

C20H23N3O — CID 42881791

IUPACN-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide
SMILESCc1cc(C)cc(-c2nc3ccccn3c2NC(=O)CC(C)C)c1
InChIInChI=1S/C20H23N3O/c1-13(2)9-18(24)22-20-19(16-11-14(3)10-15(4)12-16)21-17-7-5-6-8-23(17)20/h5-8,10-13H,9H2,1-4H3,(H,22,24)
InChIKeyJTOPBFQUWLHFSV-UHFFFAOYSA-N
MW321.42 g/mol
LogP4.60
Rot. Bonds4

About N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide

N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide (PubChem CID 42881791) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide.

Molecular Properties

Compound NameN-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide
PubChem CID42881791
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC NameN-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide
SMILESCc1cc(C)cc(-c2nc3ccccn3c2NC(=O)CC(C)C)c1
InChIInChI=1S/C20H23N3O/c1-13(2)9-18(24)22-20-19(16-11-14(3)10-15(4)12-16)21-17-7-5-6-8-23(17)20/h5-8,10-13H,9H2,1-4H3,(H,22,24)
InChIKeyJTOPBFQUWLHFSV-UHFFFAOYSA-N
XLogP4.60
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-[2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
CID 42694050
N-[2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]pentanamide
CID 42694061
trans-(1R,2R)-N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-2-phenylcyclopropane-1-carboxamide
CID 93017101
(3S)-N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-3,5,5-trimethylhexanamide
CID 93016867
3-methyl-N-[6-methyl-2-(2-methylphenyl)imidazo[1,2-a]pyridin-3-yl]butanamide
CID 42694564
N-[2-(3,5-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-2-methoxyacetamide
CID 42694795
N-(2-phenylimidazo[1,2-a]pyridin-3-yl)pentanamide
CID 3828486
2-[(4-methylphenyl)methylsulfanyl]-N-(2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 134050030
(3R)-3,5,5-trimethyl-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)hexanamide
CID 93016849
N-[2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]-2-phenylbutanamide
CID 42694065
3-cyclopentyl-N-[2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide
CID 42694053
N-[2-(3-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methylpropanamide
CID 42694469

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide?
The IUPAC name of N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide (CID 42881791) is N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide.
What is the SMILES notation for N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide?
The canonical SMILES for N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide is Cc1cc(C)cc(-c2nc3ccccn3c2NC(=O)CC(C)C)c1.
What is the InChIKey of N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide?
The InChIKey is JTOPBFQUWLHFSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O/c1-13(2)9-18(24)22-20-19(16-11-14(3)10-15(4)12-16)21-17-7-5-6-8-23(17)20/h5-8,10-13H,9H2,1-4H3,(H,22,24).
What are the key properties of N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide?
N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide has a molecular weight of 321.42 g/mol, XLogP of 4.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,5-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]-3-methylbutanamide is sourced from PubChem (CID 42881791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).