7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid

C15H15NO2 — CID 752870

IUPAC7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid
SMILESCc1ccc2nc3c(c(C(=O)O)c2c1)CCCC3
InChIInChI=1S/C15H15NO2/c1-9-6-7-13-11(8-9)14(15(17)18)10-4-2-3-5-12(10)16-13/h6-8H,2-5H2,1H3,(H,17,18)
InChIKeyZLAJPSWHTFQIKE-UHFFFAOYSA-N
MW241.29 g/mol
LogP3.12
Rot. Bonds1

About 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid

7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid (PubChem CID 752870) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid.

Molecular Properties

Compound Name7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid
PubChem CID752870
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Name7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid
SMILESCc1ccc2nc3c(c(C(=O)O)c2c1)CCCC3
InChIInChI=1S/C15H15NO2/c1-9-6-7-13-11(8-9)14(15(17)18)10-4-2-3-5-12(10)16-13/h6-8H,2-5H2,1H3,(H,17,18)
InChIKeyZLAJPSWHTFQIKE-UHFFFAOYSA-N
XLogP3.12
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

propan-2-yl 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate
CID 16600366
7-propan-2-yl-1,2,3,4-tetrahydroacridine-9-carboxylic acid
CID 82450560
(4-methylsulfonylpiperazin-1-yl)-(7-methyl-1,2,3,4-tetrahydroacridin-9-yl)methanone
CID 134025112
(2S)-2,7-dimethyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid
CID 865217
7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid
CID 865221
7-methyl-N-(5-methyl-1,3-thiazol-2-yl)-1,2,3,4-tetrahydroacridine-9-carboxamide
CID 26197572
1,2,3,4-tetrahydroacridine-9-carboxylic acid;hydrate
CID 16667447
(3-methylphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone
CID 21239885
oxolan-2-ylmethyl 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate
CID 16600369
2-(7-methyl-1,2,3,4-tetrahydroacridin-9-yl)propan-2-ol
CID 82450358
(2,5-dimethylphenyl)-(1,2,3,4-tetrahydroacridin-9-yl)methanone
CID 21239890
7-methyl-N-[2-(2-oxopiperidin-1-yl)propyl]-1,2,3,4-tetrahydroacridine-9-carboxamide
CID 166221804

Frequently Asked Questions

What is the IUPAC name of 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid?
The IUPAC name of 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid (CID 752870) is 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid.
What is the SMILES notation for 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid?
The canonical SMILES for 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid is Cc1ccc2nc3c(c(C(=O)O)c2c1)CCCC3.
What is the InChIKey of 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid?
The InChIKey is ZLAJPSWHTFQIKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c1-9-6-7-13-11(8-9)14(15(17)18)10-4-2-3-5-12(10)16-13/h6-8H,2-5H2,1H3,(H,17,18).
What are the key properties of 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid?
7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid has a molecular weight of 241.29 g/mol, XLogP of 3.12, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid is sourced from PubChem (CID 752870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).