(2,5-dimethylindazol-4-yl)carbamic acid

C10H11N3O2 — CID 174236036

IUPAC(2,5-dimethylindazol-4-yl)carbamic acid
SMILESCc1ccc2nn(C)cc2c1NC(=O)O
InChIInChI=1S/C10H11N3O2/c1-6-3-4-8-7(5-13(2)12-8)9(6)11-10(14)15/h3-5,11H,1-2H3,(H,14,15)
InChIKeySLRPPJZUVRZIDK-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.97
Rot. Bonds1

About (2,5-dimethylindazol-4-yl)carbamic acid

(2,5-dimethylindazol-4-yl)carbamic acid (PubChem CID 174236036) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is (2,5-dimethylindazol-4-yl)carbamic acid.

Molecular Properties

Compound Name(2,5-dimethylindazol-4-yl)carbamic acid
PubChem CID174236036
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name(2,5-dimethylindazol-4-yl)carbamic acid
SMILESCc1ccc2nn(C)cc2c1NC(=O)O
InChIInChI=1S/C10H11N3O2/c1-6-3-4-8-7(5-13(2)12-8)9(6)11-10(14)15/h3-5,11H,1-2H3,(H,14,15)
InChIKeySLRPPJZUVRZIDK-UHFFFAOYSA-N
XLogP1.97
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2,5-dimethylindazol-4-yl)-trifluoroboranuide
CID 74787622
5-ethyl-2-methylindazol-4-ol
CID 177040057
5-chloro-2-methylindazole-4-carboxylic acid
CID 105464530
2,4-dimethylindazole;ethane
CID 90974355
3-[(2,6-dimethylphenyl)carbamoyl]-1-methylpyrazole-4-carboxylic acid
CID 19496533
2-[(1,3-dimethylpyrazol-4-yl)carbamoyl]-3,6-dimethylbenzoic acid
CID 103429481
N-(2,6-dimethylquinolin-5-yl)-2-methylpropanamide
CID 54859248
4-[(3,4-dimethylphenyl)carbamoyl]-1-methylpyrazole-3-carboxylic acid
CID 19498518
N-(2,6-dimethylquinolin-5-yl)-4-methylbenzamide
CID 3301637
methyl 5-(3-methoxy-3-oxopropyl)-2-methylindazole-4-carboxylate
CID 59145936
N-[(3S)-3-(2-methylindazol-4-yl)pentyl]propanamide
CID 70923709
(2-chloro-4-methyl-3-pyridinyl)carbamic acid
CID 88545589

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethylindazol-4-yl)carbamic acid?
The IUPAC name of (2,5-dimethylindazol-4-yl)carbamic acid (CID 174236036) is (2,5-dimethylindazol-4-yl)carbamic acid.
What is the SMILES notation for (2,5-dimethylindazol-4-yl)carbamic acid?
The canonical SMILES for (2,5-dimethylindazol-4-yl)carbamic acid is Cc1ccc2nn(C)cc2c1NC(=O)O.
What is the InChIKey of (2,5-dimethylindazol-4-yl)carbamic acid?
The InChIKey is SLRPPJZUVRZIDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-6-3-4-8-7(5-13(2)12-8)9(6)11-10(14)15/h3-5,11H,1-2H3,(H,14,15).
What are the key properties of (2,5-dimethylindazol-4-yl)carbamic acid?
(2,5-dimethylindazol-4-yl)carbamic acid has a molecular weight of 205.22 g/mol, XLogP of 1.97, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylindazol-4-yl)carbamic acid is sourced from PubChem (CID 174236036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).