2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid

C12H19N3O2 — CID 83897617

IUPAC2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid
SMILESCC(C)c1nc(C(N)C(=O)O)c2n1CCCC2
InChIInChI=1S/C12H19N3O2/c1-7(2)11-14-10(9(13)12(16)17)8-5-3-4-6-15(8)11/h7,9H,3-6,13H2,1-2H3,(H,16,17)
InChIKeyQSPRHVWAQOVGKL-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.43
Rot. Bonds3

About 2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid

2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid (PubChem CID 83897617) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid.

Molecular Properties

Compound Name2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid
PubChem CID83897617
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid
SMILESCC(C)c1nc(C(N)C(=O)O)c2n1CCCC2
InChIInChI=1S/C12H19N3O2/c1-7(2)11-14-10(9(13)12(16)17)8-5-3-4-6-15(8)11/h7,9H,3-6,13H2,1-2H3,(H,16,17)
InChIKeyQSPRHVWAQOVGKL-UHFFFAOYSA-N
XLogP1.43
TPSA81.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid with MolForge

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Related Compounds

2-amino-1-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)ethanol
CID 83891326
2-amino-2-(2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)acetic acid
CID 83842555
2-(3-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)propanoic acid
CID 83883838
2-(1-cyano-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-3-yl)propanoic acid
CID 116984342
3-(3-aminobutyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 116984193
3-[carboxy(methylamino)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 116984284
2-hydroxy-2-(3-methyl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-1-yl)acetic acid
CID 82399811
(2R)-2-amino-2-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-yl)acetic acid
CID 95732357
7-amino-3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboxylic acid
CID 105480574
3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,8-dicarboxylic acid
CID 117249927
2-[(2R)-butan-2-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 125451701
2-[(2S)-3-methylbutan-2-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-3-carboxylic acid
CID 125453760

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid?
The IUPAC name of 2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid (CID 83897617) is 2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid.
What is the SMILES notation for 2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid?
The canonical SMILES for 2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid is CC(C)c1nc(C(N)C(=O)O)c2n1CCCC2.
What is the InChIKey of 2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid?
The InChIKey is QSPRHVWAQOVGKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-7(2)11-14-10(9(13)12(16)17)8-5-3-4-6-15(8)11/h7,9H,3-6,13H2,1-2H3,(H,16,17).
What are the key properties of 2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid?
2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid has a molecular weight of 237.30 g/mol, XLogP of 1.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(3-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)acetic acid is sourced from PubChem (CID 83897617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).