N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide

C16H11BrN6O — CID 67552245

IUPACN-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide
SMILESO=C(Nc1ccc(Br)cc1-c1nn[nH]n1)c1cc2ccccc2[nH]1
InChIInChI=1S/C16H11BrN6O/c17-10-5-6-13(11(8-10)15-20-22-23-21-15)19-16(24)14-7-9-3-1-2-4-12(9)18-14/h1-8,18H,(H,19,24)(H,20,21,22,23)
InChIKeyYMBFUIHNAAVOOB-UHFFFAOYSA-N
MW383.21 g/mol
LogP3.36
Rot. Bonds3

About N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide

N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide (PubChem CID 67552245) has the molecular formula C16H11BrN6O and a molecular weight of 383.21 g/mol. Its IUPAC name is N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide
PubChem CID67552245
Molecular FormulaC16H11BrN6O
Molecular Weight383.21 g/mol
Exact Mass382.02
IUPAC NameN-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide
SMILESO=C(Nc1ccc(Br)cc1-c1nn[nH]n1)c1cc2ccccc2[nH]1
InChIInChI=1S/C16H11BrN6O/c17-10-5-6-13(11(8-10)15-20-22-23-21-15)19-16(24)14-7-9-3-1-2-4-12(9)18-14/h1-8,18H,(H,19,24)(H,20,21,22,23)
InChIKeyYMBFUIHNAAVOOB-UHFFFAOYSA-N
XLogP3.36
TPSA99.35 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.21
LogP ≤ 53.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide 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

7-amino-N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide
CID 67551838
N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-7-[[2-(4-chlorophenyl)acetyl]amino]-1H-indole-2-carboxamide
CID 67552598
N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1,2-benzoxazole-3-carboxamide
CID 67551375
(E)-N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-naphthalen-2-ylprop-2-enamide
CID 25064125
N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1-methyl-7-phenylindole-2-carboxamide
CID 67552441
N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]cyclopentanecarboxamide
CID 126830344
N-[4-chloro-2-(2H-tetrazol-5-yl)phenyl]-7-(propanoylamino)-1H-indole-2-carboxamide
CID 67552374
N-(4-bromo-2-pyridinyl)-1H-indole-2-carboxamide
CID 102674192
N-(5-bromo-2,4-difluorophenyl)-1H-indole-2-carboxamide
CID 102854713
6-bromo-N-(2-fluorophenyl)-1H-indole-2-carboxamide
CID 47155114
5-acetamido-N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1,2-benzoxazole-3-carboxamide
CID 67551917
N-[(4-bromophenyl)methyl]-1H-indole-2-carboxamide
CID 46921176

Frequently Asked Questions

What is the IUPAC name of N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide?
The IUPAC name of N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide (CID 67552245) is N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide.
What is the SMILES notation for N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide?
The canonical SMILES for N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide is O=C(Nc1ccc(Br)cc1-c1nn[nH]n1)c1cc2ccccc2[nH]1.
What is the InChIKey of N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide?
The InChIKey is YMBFUIHNAAVOOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11BrN6O/c17-10-5-6-13(11(8-10)15-20-22-23-21-15)19-16(24)14-7-9-3-1-2-4-12(9)18-14/h1-8,18H,(H,19,24)(H,20,21,22,23).
What are the key properties of N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide?
N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide has a molecular weight of 383.21 g/mol, XLogP of 3.36, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 67552245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).