3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid

C15H19N3O3 — CID 82032893

IUPAC3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid
SMILESCCC(C)C(NC(=O)c1c(C)nc2ccccn12)C(=O)O
InChIInChI=1S/C15H19N3O3/c1-4-9(2)12(15(20)21)17-14(19)13-10(3)16-11-7-5-6-8-18(11)13/h5-9,12H,4H2,1-3H3,(H,17,19)(H,20,21)
InChIKeyZIUMAQFPVYDLCE-UHFFFAOYSA-N
MW289.33 g/mol
LogP1.87
Rot. Bonds5

About 3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid

3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid (PubChem CID 82032893) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid.

Molecular Properties

Compound Name3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid
PubChem CID82032893
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid
SMILESCCC(C)C(NC(=O)c1c(C)nc2ccccn12)C(=O)O
InChIInChI=1S/C15H19N3O3/c1-4-9(2)12(15(20)21)17-14(19)13-10(3)16-11-7-5-6-8-18(11)13/h5-9,12H,4H2,1-3H3,(H,17,19)(H,20,21)
InChIKeyZIUMAQFPVYDLCE-UHFFFAOYSA-N
XLogP1.87
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2,7-dimethylimidazo[1,2-a]pyridine-3-carbonyl)amino]-3-methylpentanoic acid
CID 82032865
N-ethyl-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 789702
(2S)-2-(imidazo[1,2-a]pyridine-2-carbonylamino)-3-methylpentanoic acid
CID 61173973
N-[1-(4-methoxyphenyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 56698718
3-methyl-2-[(3-methylsulfanylimidazo[1,5-a]pyridine-1-carbonyl)amino]pentanoic acid
CID 119212010
3-methyl-2-(pyrazolo[1,5-a]pyridine-3-carbonylamino)pentanoic acid
CID 103790711
2-methyl-N-[4-(propanoylamino)phenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 649714
(2S,3S)-3-methyl-2-[(4-methyl-1,3-oxazole-2-carbonyl)amino]pentanoic acid
CID 110835139
3-methyl-2-(quinoline-2-carbonylamino)pentanoic acid
CID 16795877
ethyl 2-methylimidazo[1,2-a]pyridine-3-carboxylate;hydrochloride
CID 52988808
3-methyl-2-[(5-methylpyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]pentanoic acid
CID 119211732
1-[(2S)-6-methylheptan-2-yl]-3-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]urea
CID 51659196

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid?
The IUPAC name of 3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid (CID 82032893) is 3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid.
What is the SMILES notation for 3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid?
The canonical SMILES for 3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid is CCC(C)C(NC(=O)c1c(C)nc2ccccn12)C(=O)O.
What is the InChIKey of 3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid?
The InChIKey is ZIUMAQFPVYDLCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-4-9(2)12(15(20)21)17-14(19)13-10(3)16-11-7-5-6-8-18(11)13/h5-9,12H,4H2,1-3H3,(H,17,19)(H,20,21).
What are the key properties of 3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid?
3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid has a molecular weight of 289.33 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-[(2-methylimidazo[1,2-a]pyridine-3-carbonyl)amino]pentanoic acid is sourced from PubChem (CID 82032893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).