2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid

C12H15N3O2 — CID 135380073

IUPAC2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid
SMILESCc1ccc2c(cnn2C)c1CCNC(=O)O
InChIInChI=1S/C12H15N3O2/c1-8-3-4-11-10(7-14-15(11)2)9(8)5-6-13-12(16)17/h3-4,7,13H,5-6H2,1-2H3,(H,16,17)
InChIKeyAUUORABABAPFET-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.69
Rot. Bonds3

About 2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid

2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid (PubChem CID 135380073) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is 2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid.

Molecular Properties

Compound Name2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid
PubChem CID135380073
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC Name2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid
SMILESCc1ccc2c(cnn2C)c1CCNC(=O)O
InChIInChI=1S/C12H15N3O2/c1-8-3-4-11-10(7-14-15(11)2)9(8)5-6-13-12(16)17/h3-4,7,13H,5-6H2,1-2H3,(H,16,17)
InChIKeyAUUORABABAPFET-UHFFFAOYSA-N
XLogP1.69
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(1,5-dimethylindazol-4-yl)ethylcarbamic 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

4-ethyl-1,5-dimethylindazole
CID 176690635
2-chloro-1-(1,4-dimethylindazol-5-yl)ethanone
CID 39104078
4-methoxy-1,5-dimethylindazole
CID 170279766
2-(2-methyl-1H-indol-3-yl)ethylcarbamic acid
CID 115171128
4-tert-butyl-1,5-dimethylindazole
CID 138655344
1,4-dimethylindazol-5-ol
CID 121228794
2-(1,2-dimethylbenzimidazol-5-yl)ethylcarbamic acid
CID 115171173
2-(3-methyl-4-oxopyridazino[4,5-b]indol-5-yl)-N-[2-(2-methylphenyl)ethyl]acetamide
CID 53054993
2-(2-methoxy-3,4,6-trimethylphenyl)ethylcarbamic acid
CID 115171197
(1,7-dimethylindazol-4-yl)methanol
CID 155733013
methyl 1,4-dimethylindazole-7-carboxylate
CID 58524149
2-amino-1-(1-methylindazol-4-yl)ethanone
CID 131191051

Frequently Asked Questions

What is the IUPAC name of 2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid?
The IUPAC name of 2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid (CID 135380073) is 2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid.
What is the SMILES notation for 2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid?
The canonical SMILES for 2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid is Cc1ccc2c(cnn2C)c1CCNC(=O)O.
What is the InChIKey of 2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid?
The InChIKey is AUUORABABAPFET-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-8-3-4-11-10(7-14-15(11)2)9(8)5-6-13-12(16)17/h3-4,7,13H,5-6H2,1-2H3,(H,16,17).
What are the key properties of 2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid?
2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid has a molecular weight of 233.27 g/mol, XLogP of 1.69, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,5-dimethylindazol-4-yl)ethylcarbamic acid is sourced from PubChem (CID 135380073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).