(2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid

C12H15N3O2 — CID 83192556

IUPAC(2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid
SMILESCc1ccc2nc(CN[C@@H](C)C(=O)O)cn2c1
InChIInChI=1S/C12H15N3O2/c1-8-3-4-11-14-10(7-15(11)6-8)5-13-9(2)12(16)17/h3-4,6-7,9,13H,5H2,1-2H3,(H,16,17)/t9-/m0/s1
InChIKeyALZDMBMSURNEML-VIFPVBQESA-N
MW233.27 g/mol
LogP1.21
Rot. Bonds4

About (2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid

(2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid (PubChem CID 83192556) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is (2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid.

Molecular Properties

Compound Name(2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid
PubChem CID83192556
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name(2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid
SMILESCc1ccc2nc(CN[C@@H](C)C(=O)O)cn2c1
InChIInChI=1S/C12H15N3O2/c1-8-3-4-11-14-10(7-15(11)6-8)5-13-9(2)12(16)17/h3-4,6-7,9,13H,5H2,1-2H3,(H,16,17)/t9-/m0/s1
InChIKeyALZDMBMSURNEML-VIFPVBQESA-N
XLogP1.21
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]propanamide
CID 47342907
3-amino-N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]butanamide;dihydrochloride
CID 119860099
3-(6-methylimidazo[1,2-a]pyridin-2-yl)propanoic acid
CID 4912874
2-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-N,N-dimethylpropanamide
CID 78959550
(2R)-2-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylamino]propanoic acid
CID 83194830
N-[(2R)-2-(ethylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]acetamide
CID 120654185
N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]pentanamide
CID 47342909
4-[methyl-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]amino]butan-2-ol
CID 113246218
N-[2-(methylamino)propyl]-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]acetamide
CID 120827427
2-methyl-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]propanoic acid
CID 81228979
N-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylsulfamoyl]-1-phenylmethanamine
CID 56916812
N-butan-2-yl-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]acetamide
CID 86920911

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid?
The IUPAC name of (2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid (CID 83192556) is (2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid.
What is the SMILES notation for (2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid?
The canonical SMILES for (2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid is Cc1ccc2nc(CN[C@@H](C)C(=O)O)cn2c1.
What is the InChIKey of (2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid?
The InChIKey is ALZDMBMSURNEML-VIFPVBQESA-N. The full InChI is InChI=1S/C12H15N3O2/c1-8-3-4-11-14-10(7-15(11)6-8)5-13-9(2)12(16)17/h3-4,6-7,9,13H,5H2,1-2H3,(H,16,17)/t9-/m0/s1.
What are the key properties of (2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid?
(2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid has a molecular weight of 233.27 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]propanoic acid is sourced from PubChem (CID 83192556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).