2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid

C12H14O2 — CID 82125541

IUPAC2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid
SMILESCc1cccc2c1C(CC(=O)O)CC2
InChIInChI=1S/C12H14O2/c1-8-3-2-4-9-5-6-10(12(8)9)7-11(13)14/h2-4,10H,5-7H2,1H3,(H,13,14)
InChIKeyLJUCAVZJWBXCED-UHFFFAOYSA-N
MW190.24 g/mol
LogP2.50
Rot. Bonds2

About 2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid

2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid (PubChem CID 82125541) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is 2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid.

Molecular Properties

Compound Name2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid
PubChem CID82125541
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Name2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid
SMILESCc1cccc2c1C(CC(=O)O)CC2
InChIInChI=1S/C12H14O2/c1-8-3-2-4-9-5-6-10(12(8)9)7-11(13)14/h2-4,10H,5-7H2,1H3,(H,13,14)
InChIKeyLJUCAVZJWBXCED-UHFFFAOYSA-N
XLogP2.50
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(5-methyl-1,2,3,4-tetrahydroquinolin-4-yl)acetic acid
CID 115023982
3-(2-amino-2-oxoethyl)-2,3-dihydro-1H-indene-4-carboxylic acid
CID 121006880
2-(8-methyl-3-oxo-2,4-dihydro-1H-naphthalen-2-yl)acetic acid
CID 121369235
2-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)acetic acid
CID 79740284
2-(8-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 83829383
2-(1-acetyl-5,8-dimethyl-3,4-dihydro-2H-quinolin-4-yl)acetic acid
CID 82623979
benzyl N-(7-methyl-2,3-dihydro-1H-inden-1-yl)carbamate
CID 167740174
2-(4,5-dimethyl-9H-fluoren-9-yl)acetic acid
CID 82578908
2-[(1S)-5-[2-(3-methyl-2-pyridinyl)ethoxy]-2,3-dihydro-1H-inden-1-yl]acetic acid
CID 67019087
methyl 8-methyl-1,2,3,4-tetrahydronaphthalene-1-carboxylate
CID 12778765
[(1S)-7-methyl-2,3-dihydro-1H-inden-1-yl]-diphenylphosphane
CID 59903542
CID 59356705
CID 59356705

Frequently Asked Questions

What is the IUPAC name of 2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid?
The IUPAC name of 2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid (CID 82125541) is 2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid.
What is the SMILES notation for 2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid?
The canonical SMILES for 2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid is Cc1cccc2c1C(CC(=O)O)CC2.
What is the InChIKey of 2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid?
The InChIKey is LJUCAVZJWBXCED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O2/c1-8-3-2-4-9-5-6-10(12(8)9)7-11(13)14/h2-4,10H,5-7H2,1H3,(H,13,14).
What are the key properties of 2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid?
2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid has a molecular weight of 190.24 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methyl-2,3-dihydro-1H-inden-1-yl)acetic acid is sourced from PubChem (CID 82125541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).