3-fluoro-4-(5-methyltetrazol-1-yl)phenol

C8H7FN4O — CID 67389681

IUPAC3-fluoro-4-(5-methyltetrazol-1-yl)phenol
SMILESCc1nnnn1-c1ccc(O)cc1F
InChIInChI=1S/C8H7FN4O/c1-5-10-11-12-13(5)8-3-2-6(14)4-7(8)9/h2-4,14H,1H3
InChIKeyHVDHRCXVXPZPBB-UHFFFAOYSA-N
MW194.17 g/mol
LogP0.82
Rot. Bonds1

About 3-fluoro-4-(5-methyltetrazol-1-yl)phenol

3-fluoro-4-(5-methyltetrazol-1-yl)phenol (PubChem CID 67389681) has the molecular formula C8H7FN4O and a molecular weight of 194.17 g/mol. Its IUPAC name is 3-fluoro-4-(5-methyltetrazol-1-yl)phenol.

Molecular Properties

Compound Name3-fluoro-4-(5-methyltetrazol-1-yl)phenol
PubChem CID67389681
Molecular FormulaC8H7FN4O
Molecular Weight194.17 g/mol
Exact Mass194.06
IUPAC Name3-fluoro-4-(5-methyltetrazol-1-yl)phenol
SMILESCc1nnnn1-c1ccc(O)cc1F
InChIInChI=1S/C8H7FN4O/c1-5-10-11-12-13(5)8-3-2-6(14)4-7(8)9/h2-4,14H,1H3
InChIKeyHVDHRCXVXPZPBB-UHFFFAOYSA-N
XLogP0.82
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.17
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-fluoro-4-(5-methyltetrazol-1-yl)phenol 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

4-(1H-1,2,3,4-tetrazol-1-yl)phenol
CID 542910
2-fluoro-4-(1H-1,2,3,4-tetrazol-1-yl)phenol
CID 58114323
4-(5-Methanesulfonyl-(1,2,3,4)tetrazol-1-yl)-phenol
CID 134824564
3-(5-methyl-1H-tetrazol-1-yl)phenol
CID 16765171
4-(5-Prop-2-enylsulfanyltetrazol-1-yl)phenol
CID 2801423
4-[5-(2-Methylsulfanylethylsulfanyl)tetrazol-1-yl]phenol
CID 8852458
4-(5-Methylsulfanyl-tetrazol-1-yl)-phenol
CID 8177440
1-(4-Methoxyphenyl)-5-methyltetrazole
CID 12409991
4-(5-Methyl-1h-1,2,4-triazol-1-yl)phenol
CID 13019894
1-(4-methoxyphenyl)-5-(trifluoromethyl)-1H-tetrazole
CID 11118262
4-(5-Trifluoromethyl-tetrazol-1-YL)-phenol
CID 21197249
2-Fluoro-4-(5-methyl-tetrazol-1-yl)-phenol
CID 22106524

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-(5-methyltetrazol-1-yl)phenol?
The IUPAC name of 3-fluoro-4-(5-methyltetrazol-1-yl)phenol (CID 67389681) is 3-fluoro-4-(5-methyltetrazol-1-yl)phenol.
What is the SMILES notation for 3-fluoro-4-(5-methyltetrazol-1-yl)phenol?
The canonical SMILES for 3-fluoro-4-(5-methyltetrazol-1-yl)phenol is Cc1nnnn1-c1ccc(O)cc1F.
What is the InChIKey of 3-fluoro-4-(5-methyltetrazol-1-yl)phenol?
The InChIKey is HVDHRCXVXPZPBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FN4O/c1-5-10-11-12-13(5)8-3-2-6(14)4-7(8)9/h2-4,14H,1H3.
What are the key properties of 3-fluoro-4-(5-methyltetrazol-1-yl)phenol?
3-fluoro-4-(5-methyltetrazol-1-yl)phenol has a molecular weight of 194.17 g/mol, XLogP of 0.82, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-(5-methyltetrazol-1-yl)phenol is sourced from PubChem (CID 67389681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).