N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline

C13H10ClN5 — CID 125465363

IUPACN-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline
SMILESClc1ccccc1Nc1ccccc1-c1nn[nH]n1
InChIInChI=1S/C13H10ClN5/c14-10-6-2-4-8-12(10)15-11-7-3-1-5-9(11)13-16-18-19-17-13/h1-8,15H,(H,16,17,18,19)
InChIKeyALNBLEVIKUNVGB-UHFFFAOYSA-N
MW271.71 g/mol
LogP3.26
Rot. Bonds3

About N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline

N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline (PubChem CID 125465363) has the molecular formula C13H10ClN5 and a molecular weight of 271.71 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline
PubChem CID125465363
Molecular FormulaC13H10ClN5
Molecular Weight271.71 g/mol
Exact Mass271.06
IUPAC NameN-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline
SMILESClc1ccccc1Nc1ccccc1-c1nn[nH]n1
InChIInChI=1S/C13H10ClN5/c14-10-6-2-4-8-12(10)15-11-7-3-1-5-9(11)13-16-18-19-17-13/h1-8,15H,(H,16,17,18,19)
InChIKeyALNBLEVIKUNVGB-UHFFFAOYSA-N
XLogP3.26
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.71
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline 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-(4-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline
CID 125465468
N-(4-methoxyphenyl)-2-(2H-tetrazol-5-yl)aniline
CID 135372809
5-(3-chloro-2-fluorophenyl)-2H-tetrazole
CID 63034901
ethane;2-(2H-tetrazol-5-yl)-N-[4-(trifluoromethoxy)phenyl]aniline
CID 142468341
3-chloro-N-[2-(2H-tetrazol-5-yl)phenyl]naphthalene-2-sulfonamide
CID 166400588
3-[3,5-dichloro-4-[7-[2,6-dichloro-4-[2-(2H-tetrazol-5-yl)anilino]phenoxy]heptoxy]phenyl]propanoic acid
CID 170371226
ethane;5-(2-methylphenyl)-2H-tetrazole
CID 91346889
2,6-dichloro-N-[2-(2H-tetrazol-5-ylmethyl)phenyl]aniline
CID 154110060
N-(2,3-dichlorophenyl)-2H-tetrazol-5-amine
CID 69263868
1-(2-chlorophenyl)-3-[4-(piperidine-1-carbonyl)-2-(2H-tetrazol-5-yl)phenyl]urea
CID 10071086
2-[5-(2H-tetrazol-5-yl)-1,3,4-oxadiazol-2-yl]-N-[4-(trifluoromethyl)phenyl]aniline
CID 155224026
5-isocyano-2-methylsulfanyl-N-[2-(2H-tetrazol-5-yl)phenyl]pyrimidin-4-amine
CID 168846052

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline?
The IUPAC name of N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline (CID 125465363) is N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline.
What is the SMILES notation for N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline?
The canonical SMILES for N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline is Clc1ccccc1Nc1ccccc1-c1nn[nH]n1.
What is the InChIKey of N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline?
The InChIKey is ALNBLEVIKUNVGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClN5/c14-10-6-2-4-8-12(10)15-11-7-3-1-5-9(11)13-16-18-19-17-13/h1-8,15H,(H,16,17,18,19).
What are the key properties of N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline?
N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline has a molecular weight of 271.71 g/mol, XLogP of 3.26, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-(2H-tetrazol-5-yl)aniline is sourced from PubChem (CID 125465363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).