1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide

C10H8N10O2 — CID 3402764

IUPAC1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide
SMILESO=C(Nc1nn[nH]n1)c1ccccc1C(=O)Nc1nn[nH]n1
InChIInChI=1S/C10H8N10O2/c21-7(11-9-13-17-18-14-9)5-3-1-2-4-6(5)8(22)12-10-15-19-20-16-10/h1-4H,(H2,11,13,14,17,18,21)(H2,12,15,16,19,20,22)
InChIKeyTWJZAHURZOYUJK-UHFFFAOYSA-N
MW300.24 g/mol
LogP-0.78
Rot. Bonds4

About 1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide

1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide (PubChem CID 3402764) has the molecular formula C10H8N10O2 and a molecular weight of 300.24 g/mol. Its IUPAC name is 1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide.

Molecular Properties

Compound Name1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide
PubChem CID3402764
Molecular FormulaC10H8N10O2
Molecular Weight300.24 g/mol
Exact Mass300.08
IUPAC Name1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide
SMILESO=C(Nc1nn[nH]n1)c1ccccc1C(=O)Nc1nn[nH]n1
InChIInChI=1S/C10H8N10O2/c21-7(11-9-13-17-18-14-9)5-3-1-2-4-6(5)8(22)12-10-15-19-20-16-10/h1-4H,(H2,11,13,14,17,18,21)(H2,12,15,16,19,20,22)
InChIKeyTWJZAHURZOYUJK-UHFFFAOYSA-N
XLogP-0.78
TPSA167.12 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.24
LogP ≤ 5-0.78
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Analyze 1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide 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

N-(2H-tetrazol-5-yl)naphthalene-1-carboxamide
CID 5100620
2-hydroxy-3-nitro-N-(2H-tetrazol-5-yl)benzamide
CID 12962786
3-methyl-2-nitro-N-(2H-tetrazol-5-yl)benzamide
CID 13267889
CID 70476554
CID 70476554
5-amino-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 135703076
5-fluoro-2-hydroxy-N-(2H-tetrazol-5-yl)benzamide
CID 12962771
2-methyl-3-[[(2S)-3-methylbutan-2-yl]amino]-N-(2H-tetrazol-5-yl)benzamide
CID 96523879
4-amino-2-methyl-N-(2H-tetrazol-5-yl)benzamide
CID 70532578
4-oxo-N-(2H-tetrazol-5-yl)-1H-1,8-naphthyridine-3-carboxamide
CID 22160545
3,5-diiodo-N-(2H-tetrazol-5-yl)benzamide
CID 3027075
3-chloro-N-(2H-tetrazol-5-yl)-1-benzothiophene-2-carboxamide
CID 2851499
3-acetamido-N-(2H-tetrazol-5-yl)-2-benzofuran-1-carboxamide
CID 70353158

Frequently Asked Questions

What is the IUPAC name of 1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide?
The IUPAC name of 1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide (CID 3402764) is 1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide.
What is the SMILES notation for 1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide?
The canonical SMILES for 1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide is O=C(Nc1nn[nH]n1)c1ccccc1C(=O)Nc1nn[nH]n1.
What is the InChIKey of 1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide?
The InChIKey is TWJZAHURZOYUJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N10O2/c21-7(11-9-13-17-18-14-9)5-3-1-2-4-6(5)8(22)12-10-15-19-20-16-10/h1-4H,(H2,11,13,14,17,18,21)(H2,12,15,16,19,20,22).
What are the key properties of 1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide?
1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide has a molecular weight of 300.24 g/mol, XLogP of -0.78, 4 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N-bis(2H-tetrazol-5-yl)benzene-1,2-dicarboxamide is sourced from PubChem (CID 3402764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).