N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine

C8H8FN5 — CID 164653277

IUPACN-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine
SMILESCc1cc(Nc2nn[nH]n2)ccc1F
InChIInChI=1S/C8H8FN5/c1-5-4-6(2-3-7(5)9)10-8-11-13-14-12-8/h2-4H,1H3,(H2,10,11,12,13,14)
InChIKeyWYEFIXUYUPAHMB-UHFFFAOYSA-N
MW193.19 g/mol
LogP1.39
Rot. Bonds2

About N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine

N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine (PubChem CID 164653277) has the molecular formula C8H8FN5 and a molecular weight of 193.19 g/mol. Its IUPAC name is N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine.

Molecular Properties

Compound NameN-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine
PubChem CID164653277
Molecular FormulaC8H8FN5
Molecular Weight193.19 g/mol
Exact Mass193.08
IUPAC NameN-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine
SMILESCc1cc(Nc2nn[nH]n2)ccc1F
InChIInChI=1S/C8H8FN5/c1-5-4-6(2-3-7(5)9)10-8-11-13-14-12-8/h2-4H,1H3,(H2,10,11,12,13,14)
InChIKeyWYEFIXUYUPAHMB-UHFFFAOYSA-N
XLogP1.39
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.19
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-fluorophenyl)-2H-tetrazol-5-amine
CID 130013830
6-ethoxy-2-N-(4-fluoro-3-methylphenyl)-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80825210
4-fluoro-N-(hydrazinylmethyl)-3-methylaniline
CID 115260421
4-bromo-N-(4-fluoro-3-methylphenyl)-1,3-thiazol-2-amine
CID 79398809
4-N-(4-fluoro-3-methylphenyl)-2-N,6-dimethylpyrimidine-2,4-diamine
CID 80824530
N-(bromomethyl)-4-fluoro-3-methylaniline
CID 115261522
N-(4-fluoro-3-methylphenyl)-2-hydrazinyl-6-methylpyrimidin-4-amine
CID 80919313
6-N-ethyl-4-N-(4-fluoro-3-methylphenyl)-2-methylpyrimidine-4,6-diamine
CID 80825643
2-[2-(4-fluoro-3-methylanilino)-6-methylpyrimidin-4-yl]oxyacetonitrile
CID 95922444
(4-fluoro-3-methylphenyl)hydrazine;hydrochloride
CID 18355387
N-(4-fluoro-3-methylphenyl)-4-[2-methyl-4-(trifluoromethyl)-1,3-thiazol-5-yl]pyrimidin-2-amine
CID 67349230
3-N,6-N-bis(2H-tetrazol-5-yl)-1,2,4,5-tetrazine-3,6-diamine
CID 13007484

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine?
The IUPAC name of N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine (CID 164653277) is N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine.
What is the SMILES notation for N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine?
The canonical SMILES for N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine is Cc1cc(Nc2nn[nH]n2)ccc1F.
What is the InChIKey of N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine?
The InChIKey is WYEFIXUYUPAHMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FN5/c1-5-4-6(2-3-7(5)9)10-8-11-13-14-12-8/h2-4H,1H3,(H2,10,11,12,13,14).
What are the key properties of N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine?
N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine has a molecular weight of 193.19 g/mol, XLogP of 1.39, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-methylphenyl)-2H-tetrazol-5-amine is sourced from PubChem (CID 164653277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).