2-methyl-2H-carbazole-3-carboxylic acid

C14H11NO2 — CID 18428424

IUPAC2-methyl-2H-carbazole-3-carboxylic acid
SMILESCC1C=C2N=c3ccccc3=C2C=C1C(=O)O
InChIInChI=1S/C14H11NO2/c1-8-6-13-11(7-10(8)14(16)17)9-4-2-3-5-12(9)15-13/h2-8H,1H3,(H,16,17)
InChIKeyMKWBVBYHRWFWSJ-UHFFFAOYSA-N
MW225.25 g/mol
LogP1.02
Rot. Bonds1

About 2-methyl-2H-carbazole-3-carboxylic acid

2-methyl-2H-carbazole-3-carboxylic acid (PubChem CID 18428424) has the molecular formula C14H11NO2 and a molecular weight of 225.25 g/mol. Its IUPAC name is 2-methyl-2H-carbazole-3-carboxylic acid.

Molecular Properties

Compound Name2-methyl-2H-carbazole-3-carboxylic acid
PubChem CID18428424
Molecular FormulaC14H11NO2
Molecular Weight225.25 g/mol
Exact Mass225.08
IUPAC Name2-methyl-2H-carbazole-3-carboxylic acid
SMILESCC1C=C2N=c3ccccc3=C2C=C1C(=O)O
InChIInChI=1S/C14H11NO2/c1-8-6-13-11(7-10(8)14(16)17)9-4-2-3-5-12(9)15-13/h2-8H,1H3,(H,16,17)
InChIKeyMKWBVBYHRWFWSJ-UHFFFAOYSA-N
XLogP1.02
TPSA49.66 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2H-carbazole-3-carboxylic acid?
The IUPAC name of 2-methyl-2H-carbazole-3-carboxylic acid (CID 18428424) is 2-methyl-2H-carbazole-3-carboxylic acid.
What is the SMILES notation for 2-methyl-2H-carbazole-3-carboxylic acid?
The canonical SMILES for 2-methyl-2H-carbazole-3-carboxylic acid is CC1C=C2N=c3ccccc3=C2C=C1C(=O)O.
What is the InChIKey of 2-methyl-2H-carbazole-3-carboxylic acid?
The InChIKey is MKWBVBYHRWFWSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO2/c1-8-6-13-11(7-10(8)14(16)17)9-4-2-3-5-12(9)15-13/h2-8H,1H3,(H,16,17).
What are the key properties of 2-methyl-2H-carbazole-3-carboxylic acid?
2-methyl-2H-carbazole-3-carboxylic acid has a molecular weight of 225.25 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2H-carbazole-3-carboxylic acid is sourced from PubChem (CID 18428424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).