3-(dimethylamino)-1-methylindazole-5-carboxylic acid

C11H13N3O2 — CID 83836892

IUPAC3-(dimethylamino)-1-methylindazole-5-carboxylic acid
SMILESCN(C)c1nn(C)c2ccc(C(=O)O)cc12
InChIInChI=1S/C11H13N3O2/c1-13(2)10-8-6-7(11(15)16)4-5-9(8)14(3)12-10/h4-6H,1-3H3,(H,15,16)
InChIKeyFNSUHQHZJMUANK-UHFFFAOYSA-N
MW219.24 g/mol
LogP1.34
Rot. Bonds2

About 3-(dimethylamino)-1-methylindazole-5-carboxylic acid

3-(dimethylamino)-1-methylindazole-5-carboxylic acid (PubChem CID 83836892) has the molecular formula C11H13N3O2 and a molecular weight of 219.24 g/mol. Its IUPAC name is 3-(dimethylamino)-1-methylindazole-5-carboxylic acid.

Molecular Properties

Compound Name3-(dimethylamino)-1-methylindazole-5-carboxylic acid
PubChem CID83836892
Molecular FormulaC11H13N3O2
Molecular Weight219.24 g/mol
Exact Mass219.10
IUPAC Name3-(dimethylamino)-1-methylindazole-5-carboxylic acid
SMILESCN(C)c1nn(C)c2ccc(C(=O)O)cc12
InChIInChI=1S/C11H13N3O2/c1-13(2)10-8-6-7(11(15)16)4-5-9(8)14(3)12-10/h4-6H,1-3H3,(H,15,16)
InChIKeyFNSUHQHZJMUANK-UHFFFAOYSA-N
XLogP1.34
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(dimethylamino)-1-methylindazole-5-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

Related Compounds

methyl 3-(dimethylamino)-1-methylindazole-6-carboxylate
CID 156503325
9-[6-(3,6-dicarboxycarbazol-9-yl)hexyl]carbazole-3,6-dicarboxylic acid
CID 53342508
3-(1-fluoroethyl)-1-methylindazole-6-carboxylic acid
CID 84687432
1-methyl-5-(1-methylpiperidine-4-carbonyl)indazole-3-carboxylic acid
CID 170083056
3-ethyl-1-methylindazole-5-carboxamide
CID 171772893
5-amino-1-methylindazole-3-carboxylic acid
CID 84663060
3-iodo-1-methyl-N-phenylindazole-5-carboxamide
CID 164590946
3-cyano-2-methylindazole-5-carboxylic acid;ethane
CID 170759805
3-(hydroxymethyl)-1-propan-2-ylindole-5-carboxylic acid
CID 117175803
2,3-dimethyl-1-propan-2-ylindole-5-carboxylic acid
CID 83944287
4-amino-3-(dimethylamino)benzoic acid
CID 82785522
CID 69397190
CID 69397190

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-1-methylindazole-5-carboxylic acid?
The IUPAC name of 3-(dimethylamino)-1-methylindazole-5-carboxylic acid (CID 83836892) is 3-(dimethylamino)-1-methylindazole-5-carboxylic acid.
What is the SMILES notation for 3-(dimethylamino)-1-methylindazole-5-carboxylic acid?
The canonical SMILES for 3-(dimethylamino)-1-methylindazole-5-carboxylic acid is CN(C)c1nn(C)c2ccc(C(=O)O)cc12.
What is the InChIKey of 3-(dimethylamino)-1-methylindazole-5-carboxylic acid?
The InChIKey is FNSUHQHZJMUANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2/c1-13(2)10-8-6-7(11(15)16)4-5-9(8)14(3)12-10/h4-6H,1-3H3,(H,15,16).
What are the key properties of 3-(dimethylamino)-1-methylindazole-5-carboxylic acid?
3-(dimethylamino)-1-methylindazole-5-carboxylic acid has a molecular weight of 219.24 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-1-methylindazole-5-carboxylic acid is sourced from PubChem (CID 83836892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).