2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid

C14H17N3O3 — CID 119192037

IUPAC2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid
SMILESCCCC(C)(NC(=O)c1ccc2nccn2c1)C(=O)O
InChIInChI=1S/C14H17N3O3/c1-3-6-14(2,13(19)20)16-12(18)10-4-5-11-15-7-8-17(11)9-10/h4-5,7-9H,3,6H2,1-2H3,(H,16,18)(H,19,20)
InChIKeyHZQMFFBYZVZGFV-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.71
Rot. Bonds5

About 2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid

2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid (PubChem CID 119192037) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid.

Molecular Properties

Compound Name2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid
PubChem CID119192037
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid
SMILESCCCC(C)(NC(=O)c1ccc2nccn2c1)C(=O)O
InChIInChI=1S/C14H17N3O3/c1-3-6-14(2,13(19)20)16-12(18)10-4-5-11-15-7-8-17(11)9-10/h4-5,7-9H,3,6H2,1-2H3,(H,16,18)(H,19,20)
InChIKeyHZQMFFBYZVZGFV-UHFFFAOYSA-N
XLogP1.71
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid?
The IUPAC name of 2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid (CID 119192037) is 2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid.
What is the SMILES notation for 2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid?
The canonical SMILES for 2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid is CCCC(C)(NC(=O)c1ccc2nccn2c1)C(=O)O.
What is the InChIKey of 2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid?
The InChIKey is HZQMFFBYZVZGFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-3-6-14(2,13(19)20)16-12(18)10-4-5-11-15-7-8-17(11)9-10/h4-5,7-9H,3,6H2,1-2H3,(H,16,18)(H,19,20).
What are the key properties of 2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid?
2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid has a molecular weight of 275.31 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(imidazo[1,2-a]pyridine-6-carbonylamino)-2-methylpentanoic acid is sourced from PubChem (CID 119192037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).