3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid

C15H19N3O3 — CID 84567691

IUPAC3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid
SMILESCc1nc2ccccn2c1CCC(=O)N(C)CCC(=O)O
InChIInChI=1S/C15H19N3O3/c1-11-12(18-9-4-3-5-13(18)16-11)6-7-14(19)17(2)10-8-15(20)21/h3-5,9H,6-8,10H2,1-2H3,(H,20,21)
InChIKeyPJMKYYGRFFBJQC-UHFFFAOYSA-N
MW289.33 g/mol
LogP1.51
Rot. Bonds6

About 3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid

3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid (PubChem CID 84567691) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid.

Molecular Properties

Compound Name3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid
PubChem CID84567691
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid
SMILESCc1nc2ccccn2c1CCC(=O)N(C)CCC(=O)O
InChIInChI=1S/C15H19N3O3/c1-11-12(18-9-4-3-5-13(18)16-11)6-7-14(19)17(2)10-8-15(20)21/h3-5,9H,6-8,10H2,1-2H3,(H,20,21)
InChIKeyPJMKYYGRFFBJQC-UHFFFAOYSA-N
XLogP1.51
TPSA74.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoate
CID 84561935
3-(2-methylimidazo[1,2-a]pyridin-3-yl)-N,N-bis(2-methylpropyl)propanamide
CID 84565205
3-(2-methylimidazo[1,2-a]pyridin-3-yl)-N,N-bis(prop-2-enyl)propanamide
CID 84565916
N-[4-(dimethylamino)butyl]-3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 84565905
3-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-(2,4,6-trimethylphenyl)propanamide
CID 84569535
3-[2-[3-[methyl-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]amino]-3-oxopropyl]-5-oxopyrrolidin-2-yl]propanoic acid
CID 91777542
N-(3-methoxypropyl)-3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 84565197
N-(4-tert-butylphenyl)-3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 84569578
N-(4-ethylphenyl)-3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanamide
CID 84569581
3-(2-methoxyethyl)-2-methylimidazo[1,2-a]pyridine
CID 130909325
3-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-(2H-tetrazol-5-yl)propanamide
CID 84561942
2-hydroxy-5-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoylamino]benzoic acid
CID 84561430

Frequently Asked Questions

What is the IUPAC name of 3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid?
The IUPAC name of 3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid (CID 84567691) is 3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid.
What is the SMILES notation for 3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid?
The canonical SMILES for 3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid is Cc1nc2ccccn2c1CCC(=O)N(C)CCC(=O)O.
What is the InChIKey of 3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid?
The InChIKey is PJMKYYGRFFBJQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-11-12(18-9-4-3-5-13(18)16-11)6-7-14(19)17(2)10-8-15(20)21/h3-5,9H,6-8,10H2,1-2H3,(H,20,21).
What are the key properties of 3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid?
3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid has a molecular weight of 289.33 g/mol, XLogP of 1.51, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl-[3-(2-methylimidazo[1,2-a]pyridin-3-yl)propanoyl]amino]propanoic acid is sourced from PubChem (CID 84567691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).