1-(4-chlorophenyl)tetrazol-5-amine

C7H6ClN5 — CID 1473133

IUPAC1-(4-chlorophenyl)tetrazol-5-amine
SMILESNc1nnnn1-c1ccc(Cl)cc1
InChIInChI=1S/C7H6ClN5/c8-5-1-3-6(4-2-5)13-7(9)10-11-12-13/h1-4H,(H2,9,10,12)
InChIKeyODJAMMJWPPTQSR-UHFFFAOYSA-N
MW195.61 g/mol
LogP0.90
Rot. Bonds1

About 1-(4-chlorophenyl)tetrazol-5-amine

1-(4-chlorophenyl)tetrazol-5-amine (PubChem CID 1473133) has the molecular formula C7H6ClN5 and a molecular weight of 195.61 g/mol. Its IUPAC name is 1-(4-chlorophenyl)tetrazol-5-amine.

Molecular Properties

Compound Name1-(4-chlorophenyl)tetrazol-5-amine
PubChem CID1473133
Molecular FormulaC7H6ClN5
Molecular Weight195.61 g/mol
Exact Mass195.03
IUPAC Name1-(4-chlorophenyl)tetrazol-5-amine
SMILESNc1nnnn1-c1ccc(Cl)cc1
InChIInChI=1S/C7H6ClN5/c8-5-1-3-6(4-2-5)13-7(9)10-11-12-13/h1-4H,(H2,9,10,12)
InChIKeyODJAMMJWPPTQSR-UHFFFAOYSA-N
XLogP0.90
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.61
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Fenamole
CID 21640
1H-Tetrazole, 5-chloro-1-phenyl-
CID 84262
1-(4-chlorophenyl)-1H-tetrazole
CID 270006
N~3~-(4-Chlorophenyl)-1H-1,2,4-triazole-3,5-diamine
CID 720561
1-[4-Chlorophenyl]-N,N-dimethyl-1H-tetrazol-5-amine
CID 539378
N-[1-(2,4-dichlorophenyl)-1H-1,2,3,4-tetraazol-5-yl]-N,N-dimethylamine
CID 1475255
1H-Tetrazole, 1-(4-chlorophenyl)-5-methyl-
CID 581477
1,2,3,4-Thiatriazol-5-amine, N-(4-chlorophenyl)-
CID 936108
1-(4-chlorophenyl)-5-(methylthio)-1H-tetrazole
CID 1243254
5-Iodo-1-phenyltetrazole
CID 914502
1-(3-Chlorophenyl)-1h-tetrazol-5-amine
CID 285134
5-Amino-O-chlorophenyl tetrazole
CID 323184

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)tetrazol-5-amine?
The IUPAC name of 1-(4-chlorophenyl)tetrazol-5-amine (CID 1473133) is 1-(4-chlorophenyl)tetrazol-5-amine.
What is the SMILES notation for 1-(4-chlorophenyl)tetrazol-5-amine?
The canonical SMILES for 1-(4-chlorophenyl)tetrazol-5-amine is Nc1nnnn1-c1ccc(Cl)cc1.
What is the InChIKey of 1-(4-chlorophenyl)tetrazol-5-amine?
The InChIKey is ODJAMMJWPPTQSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClN5/c8-5-1-3-6(4-2-5)13-7(9)10-11-12-13/h1-4H,(H2,9,10,12).
What are the key properties of 1-(4-chlorophenyl)tetrazol-5-amine?
1-(4-chlorophenyl)tetrazol-5-amine has a molecular weight of 195.61 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)tetrazol-5-amine is sourced from PubChem (CID 1473133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).