(2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid

C10H11N3O2 — CID 96765274

IUPAC(2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid
SMILESN[C@@H](Cc1ccn2ccnc2c1)C(=O)O
InChIInChI=1S/C10H11N3O2/c11-8(10(14)15)5-7-1-3-13-4-2-12-9(13)6-7/h1-4,6,8H,5,11H2,(H,14,15)/t8-/m0/s1
InChIKeyIVPPYZJEMUDCEU-QMMMGPOBSA-N
MW205.22 g/mol
LogP0.29
Rot. Bonds3

About (2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid

(2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid (PubChem CID 96765274) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is (2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid.

Molecular Properties

Compound Name(2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid
PubChem CID96765274
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name(2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid
SMILESN[C@@H](Cc1ccn2ccnc2c1)C(=O)O
InChIInChI=1S/C10H11N3O2/c11-8(10(14)15)5-7-1-3-13-4-2-12-9(13)6-7/h1-4,6,8H,5,11H2,(H,14,15)/t8-/m0/s1
InChIKeyIVPPYZJEMUDCEU-QMMMGPOBSA-N
XLogP0.29
TPSA80.62 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-[4-(1-methylimidazol-2-yl)phenyl]propanoic acid
CID 117365060
2-amino-3-[3-[(1-aminoimidazol-2-yl)sulfinylmethyl]phenyl]propanoic acid
CID 143236075
N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-4-methylpentanamide
CID 72699350
sodium;(2R)-2-amino-3-phenylpropanoic acid;chloride
CID 174870632
3-amino-N-(imidazo[1,2-a]pyridin-7-ylmethyl)cyclopentane-1-carboxamide
CID 119889498
(2S)-2-amino-3-((613C)cyclohexatrienyl)propanoic acid
CID 66995721
N-(imidazo[1,2-a]pyridin-7-ylmethyl)-1,3-thiazolidine-4-carboxamide
CID 119889546
N-(2-aminoethyl)imidazo[1,2-a]pyridine-7-carboxamide
CID 172844439
N-[4-(imidazo[1,2-a]pyridin-7-ylmethylcarbamoylamino)phenyl]-2-propan-2-yloxyacetamide
CID 72699440
2-amino-3-(2-ethoxycarbonyl-4-pyridinyl)propanoic acid
CID 90034851
(2R)-2-amino-3-(3,4-dimethylphenyl)propanoic acid
CID 56845605
tris((2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoic acid);cerium
CID 163286860

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid?
The IUPAC name of (2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid (CID 96765274) is (2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid.
What is the SMILES notation for (2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid?
The canonical SMILES for (2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid is N[C@@H](Cc1ccn2ccnc2c1)C(=O)O.
What is the InChIKey of (2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid?
The InChIKey is IVPPYZJEMUDCEU-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H11N3O2/c11-8(10(14)15)5-7-1-3-13-4-2-12-9(13)6-7/h1-4,6,8H,5,11H2,(H,14,15)/t8-/m0/s1.
What are the key properties of (2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid?
(2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid has a molecular weight of 205.22 g/mol, XLogP of 0.29, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-3-imidazo[1,2-a]pyridin-7-ylpropanoic acid is sourced from PubChem (CID 96765274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).