1-(2,4-dichlorophenyl)tetrazol-5-amine

C7H5Cl2N5 — CID 23273939

IUPAC1-(2,4-dichlorophenyl)tetrazol-5-amine
SMILESNc1nnnn1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C7H5Cl2N5/c8-4-1-2-6(5(9)3-4)14-7(10)11-12-13-14/h1-3H,(H2,10,11,13)
InChIKeyWOEULINOTMQOJQ-UHFFFAOYSA-N
MW230.06 g/mol
LogP1.55
Rot. Bonds1

About 1-(2,4-dichlorophenyl)tetrazol-5-amine

1-(2,4-dichlorophenyl)tetrazol-5-amine (PubChem CID 23273939) has the molecular formula C7H5Cl2N5 and a molecular weight of 230.06 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)tetrazol-5-amine.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)tetrazol-5-amine
PubChem CID23273939
Molecular FormulaC7H5Cl2N5
Molecular Weight230.06 g/mol
Exact Mass228.99
IUPAC Name1-(2,4-dichlorophenyl)tetrazol-5-amine
SMILESNc1nnnn1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C7H5Cl2N5/c8-4-1-2-6(5(9)3-4)14-7(10)11-12-13-14/h1-3H,(H2,10,11,13)
InChIKeyWOEULINOTMQOJQ-UHFFFAOYSA-N
XLogP1.55
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.06
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Fenamole
CID 21640
1-(4-chlorophenyl)-1H-tetrazole
CID 270006
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-(4-chlorophenyl)-5-(methylthio)-1H-tetrazole
CID 1243254
1-(3-Chlorophenyl)-1h-tetrazol-5-amine
CID 285134
5-Amino-O-chlorophenyl tetrazole
CID 323184
2-chloro-5-(1H-1,2,3,4-tetrazol-1-yl)aniline
CID 16776053
1-(4-chloro-2-iodophenyl)-1H-1,2,3,4-tetrazole
CID 66698384
Tetrazole,5-amino-1-(4-chlorophenyl)
CID 1473133
5-Chloro-1-[4-chlorophenyl]-1H-tetrazole
CID 591993

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dichlorophenyl)tetrazol-5-amine?
The IUPAC name of 1-(2,4-dichlorophenyl)tetrazol-5-amine (CID 23273939) is 1-(2,4-dichlorophenyl)tetrazol-5-amine.
What is the SMILES notation for 1-(2,4-dichlorophenyl)tetrazol-5-amine?
The canonical SMILES for 1-(2,4-dichlorophenyl)tetrazol-5-amine is Nc1nnnn1-c1ccc(Cl)cc1Cl.
What is the InChIKey of 1-(2,4-dichlorophenyl)tetrazol-5-amine?
The InChIKey is WOEULINOTMQOJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5Cl2N5/c8-4-1-2-6(5(9)3-4)14-7(10)11-12-13-14/h1-3H,(H2,10,11,13).
What are the key properties of 1-(2,4-dichlorophenyl)tetrazol-5-amine?
1-(2,4-dichlorophenyl)tetrazol-5-amine has a molecular weight of 230.06 g/mol, XLogP of 1.55, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)tetrazol-5-amine is sourced from PubChem (CID 23273939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).