4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid

C12H18N2O2 — CID 83890689

IUPAC4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid
SMILESCC1CCCn2cnc(CCCC(=O)O)c21
InChIInChI=1S/C12H18N2O2/c1-9-4-3-7-14-8-13-10(12(9)14)5-2-6-11(15)16/h8-9H,2-7H2,1H3,(H,15,16)
InChIKeyVZEZYQFGWDCPRC-UHFFFAOYSA-N
MW222.29 g/mol
LogP2.19
Rot. Bonds4

About 4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid

4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid (PubChem CID 83890689) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid.

Molecular Properties

Compound Name4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid
PubChem CID83890689
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid
SMILESCC1CCCn2cnc(CCCC(=O)O)c21
InChIInChI=1S/C12H18N2O2/c1-9-4-3-7-14-8-13-10(12(9)14)5-2-6-11(15)16/h8-9H,2-7H2,1H3,(H,15,16)
InChIKeyVZEZYQFGWDCPRC-UHFFFAOYSA-N
XLogP2.19
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-methyl-2-oxopiperidin-1-yl)pentanoic acid
CID 104679844
N'-hydroxy-8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-carboximidamide
CID 83878922
4-[6-(3-carboxypropyl)-5-methyl-3-pyridinyl]butanoic acid
CID 70628772
4-(4-cyclopentyl-1-methylimidazol-2-yl)butanoic acid
CID 84699542
4-(2-cyclopropylpyrimidin-4-yl)butanoic acid
CID 83857577
3-[(3R)-3-methylpiperidin-1-yl]propanoic acid
CID 7258528
4-(5-methyl-1H-imidazol-4-yl)butanoic acid
CID 565590
6-[(2R)-2-methylpyrrolidin-1-yl]hexanoic acid
CID 174674444
hexanedioic acid;bis(3-(1-methylpyrrolidin-2-yl)pyridine)
CID 137374704
3-[1-(3-methylpyrazin-2-yl)piperidin-3-yl]propanoic acid
CID 83064668
3-(2-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-4-yl)propanoic acid
CID 83883880
4-[2-(1-methylazepan-4-yl)phenyl]butanoic acid
CID 117440756

Frequently Asked Questions

What is the IUPAC name of 4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid?
The IUPAC name of 4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid (CID 83890689) is 4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid.
What is the SMILES notation for 4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid?
The canonical SMILES for 4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid is CC1CCCn2cnc(CCCC(=O)O)c21.
What is the InChIKey of 4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid?
The InChIKey is VZEZYQFGWDCPRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-9-4-3-7-14-8-13-10(12(9)14)5-2-6-11(15)16/h8-9H,2-7H2,1H3,(H,15,16).
What are the key properties of 4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid?
4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid has a molecular weight of 222.29 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(8-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)butanoic acid is sourced from PubChem (CID 83890689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).