(2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone

C15H15N7O — CID 166313668

IUPAC(2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone
SMILESCc1cc(C(=O)N2CCc3c(-c4nn[nH]n4)cccc32)n(C)n1
InChIInChI=1S/C15H15N7O/c1-9-8-13(21(2)18-9)15(23)22-7-6-10-11(4-3-5-12(10)22)14-16-19-20-17-14/h3-5,8H,6-7H2,1-2H3,(H,16,17,19,20)
InChIKeyHURWGLCJCVWSJW-UHFFFAOYSA-N
MW309.33 g/mol
LogP1.11
Rot. Bonds2

About (2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone

(2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone (PubChem CID 166313668) has the molecular formula C15H15N7O and a molecular weight of 309.33 g/mol. Its IUPAC name is (2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone.

Molecular Properties

Compound Name(2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone
PubChem CID166313668
Molecular FormulaC15H15N7O
Molecular Weight309.33 g/mol
Exact Mass309.13
IUPAC Name(2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone
SMILESCc1cc(C(=O)N2CCc3c(-c4nn[nH]n4)cccc32)n(C)n1
InChIInChI=1S/C15H15N7O/c1-9-8-13(21(2)18-9)15(23)22-7-6-10-11(4-3-5-12(10)22)14-16-19-20-17-14/h3-5,8H,6-7H2,1-2H3,(H,16,17,19,20)
InChIKeyHURWGLCJCVWSJW-UHFFFAOYSA-N
XLogP1.11
TPSA92.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone 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 (2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone?
The IUPAC name of (2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone (CID 166313668) is (2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone.
What is the SMILES notation for (2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone?
The canonical SMILES for (2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone is Cc1cc(C(=O)N2CCc3c(-c4nn[nH]n4)cccc32)n(C)n1.
What is the InChIKey of (2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone?
The InChIKey is HURWGLCJCVWSJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N7O/c1-9-8-13(21(2)18-9)15(23)22-7-6-10-11(4-3-5-12(10)22)14-16-19-20-17-14/h3-5,8H,6-7H2,1-2H3,(H,16,17,19,20).
What are the key properties of (2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone?
(2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone has a molecular weight of 309.33 g/mol, XLogP of 1.11, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethylpyrazol-3-yl)-[4-(2H-tetrazol-5-yl)-2,3-dihydroindol-1-yl]methanone is sourced from PubChem (CID 166313668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).