N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine

C14H9Cl3FN5 — CID 54584622

IUPACN-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine
SMILESFc1ccc(Cl)cc1CNc1nnnn1-c1cccc(Cl)c1Cl
InChIInChI=1S/C14H9Cl3FN5/c15-9-4-5-11(18)8(6-9)7-19-14-20-21-22-23(14)12-3-1-2-10(16)13(12)17/h1-6H,7H2,(H,19,20,22)
InChIKeyAHRNIFSVDCZWAR-UHFFFAOYSA-N
MW372.62 g/mol
LogP4.37
Rot. Bonds4

About N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine

N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine (PubChem CID 54584622) has the molecular formula C14H9Cl3FN5 and a molecular weight of 372.62 g/mol. Its IUPAC name is N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine.

Molecular Properties

Compound NameN-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine
PubChem CID54584622
Molecular FormulaC14H9Cl3FN5
Molecular Weight372.62 g/mol
Exact Mass370.99
IUPAC NameN-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine
SMILESFc1ccc(Cl)cc1CNc1nnnn1-c1cccc(Cl)c1Cl
InChIInChI=1S/C14H9Cl3FN5/c15-9-4-5-11(18)8(6-9)7-19-14-20-21-22-23(14)12-3-1-2-10(16)13(12)17/h1-6H,7H2,(H,19,20,22)
InChIKeyAHRNIFSVDCZWAR-UHFFFAOYSA-N
XLogP4.37
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.62
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine 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~5~-(2-chlorobenzyl)-1-phenyl-1H-1,2,4-triazole-3,5-diamine
CID 8071206
N-benzyl-1-(2,3-dichlorophenyl)tetrazol-5-amine
CID 11508020
1-(2,3-dichlorophenyl)-N-[2-(methylthio)benzyl]-1H-tetrazol-5-amine
CID 11523472
1-(2,3-dichlorophenyl)-N-[(1R)-1-phenylethyl]tetrazol-5-amine
CID 11537311
2-[[[1-(2,3-Dichlorophenyl)tetrazol-5-yl]amino]methyl]benzonitrile
CID 11544727
1-(2,3-dichlorophenyl)-N-[(2-methylphenyl)methyl]-1H-tetraazol-5-amine
CID 11652890
1-(2,3-dichlorophenyl)-N-[(1S)-2,3-dihydro-1H-inden-1-yl]tetrazol-5-amine
CID 11709955
2-(2,3-dichlorophenyl)-N-[(2-methylphenyl)methyl]-1,2,4-triazol-3-amine
CID 44453839
N-benzyl-2-(2,3-dichlorophenyl)-1,2,4-triazol-3-amine
CID 44453843
1-(2,3-dichlorophenyl)-N-[(3-fluorophenyl)methyl]tetrazol-5-amine
CID 54580660
N-[(3-chlorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine
CID 54580661
1-(2,3-dichlorophenyl)-N-[[2-(trifluoromethyl)phenyl]methyl]tetrazol-5-amine
CID 54580681

Frequently Asked Questions

What is the IUPAC name of N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine?
The IUPAC name of N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine (CID 54584622) is N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine.
What is the SMILES notation for N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine?
The canonical SMILES for N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine is Fc1ccc(Cl)cc1CNc1nnnn1-c1cccc(Cl)c1Cl.
What is the InChIKey of N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine?
The InChIKey is AHRNIFSVDCZWAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl3FN5/c15-9-4-5-11(18)8(6-9)7-19-14-20-21-22-23(14)12-3-1-2-10(16)13(12)17/h1-6H,7H2,(H,19,20,22).
What are the key properties of N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine?
N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine has a molecular weight of 372.62 g/mol, XLogP of 4.37, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-chloro-2-fluorophenyl)methyl]-1-(2,3-dichlorophenyl)tetrazol-5-amine is sourced from PubChem (CID 54584622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).