5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid

C16H15N3O2 — CID 136609405

IUPAC5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid
SMILESCC1(C)Cc2cn[nH]c2-c2[nH]c3ccc(C(=O)O)cc3c21
InChIInChI=1S/C16H15N3O2/c1-16(2)6-9-7-17-19-13(9)14-12(16)10-5-8(15(20)21)3-4-11(10)18-14/h3-5,7,18H,6H2,1-2H3,(H,17,19)(H,20,21)
InChIKeySGTQLLNCHMRSQM-UHFFFAOYSA-N
MW281.32 g/mol
LogP3.09
Rot. Bonds1

About 5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid

5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid (PubChem CID 136609405) has the molecular formula C16H15N3O2 and a molecular weight of 281.32 g/mol. Its IUPAC name is 5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid.

Molecular Properties

Compound Name5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid
PubChem CID136609405
Molecular FormulaC16H15N3O2
Molecular Weight281.32 g/mol
Exact Mass281.12
IUPAC Name5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid
SMILESCC1(C)Cc2cn[nH]c2-c2[nH]c3ccc(C(=O)O)cc3c21
InChIInChI=1S/C16H15N3O2/c1-16(2)6-9-7-17-19-13(9)14-12(16)10-5-8(15(20)21)3-4-11(10)18-14/h3-5,7,18H,6H2,1-2H3,(H,17,19)(H,20,21)
InChIKeySGTQLLNCHMRSQM-UHFFFAOYSA-N
XLogP3.09
TPSA81.77 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 53.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid?
The IUPAC name of 5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid (CID 136609405) is 5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid.
What is the SMILES notation for 5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid?
The canonical SMILES for 5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid is CC1(C)Cc2cn[nH]c2-c2[nH]c3ccc(C(=O)O)cc3c21.
What is the InChIKey of 5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid?
The InChIKey is SGTQLLNCHMRSQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-16(2)6-9-7-17-19-13(9)14-12(16)10-5-8(15(20)21)3-4-11(10)18-14/h3-5,7,18H,6H2,1-2H3,(H,17,19)(H,20,21).
What are the key properties of 5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid?
5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid has a molecular weight of 281.32 g/mol, XLogP of 3.09, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-4,10-dihydro-1H-pyrazolo[5,4-a]carbazole-7-carboxylic acid is sourced from PubChem (CID 136609405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).