2-(furan-2-yl)-5-phenyltetrazole

C11H8N4O — CID 66611423

IUPAC2-(furan-2-yl)-5-phenyltetrazole
SMILESc1ccc(-c2nnn(-c3ccco3)n2)cc1
InChIInChI=1S/C11H8N4O/c1-2-5-9(6-3-1)11-12-14-15(13-11)10-7-4-8-16-10/h1-8H
InChIKeyLAWJDVRMWVCZQP-UHFFFAOYSA-N
MW212.21 g/mol
LogP1.92
Rot. Bonds2

About 2-(furan-2-yl)-5-phenyltetrazole

2-(furan-2-yl)-5-phenyltetrazole (PubChem CID 66611423) has the molecular formula C11H8N4O and a molecular weight of 212.21 g/mol. Its IUPAC name is 2-(furan-2-yl)-5-phenyltetrazole.

Molecular Properties

Compound Name2-(furan-2-yl)-5-phenyltetrazole
PubChem CID66611423
Molecular FormulaC11H8N4O
Molecular Weight212.21 g/mol
Exact Mass212.07
IUPAC Name2-(furan-2-yl)-5-phenyltetrazole
SMILESc1ccc(-c2nnn(-c3ccco3)n2)cc1
InChIInChI=1S/C11H8N4O/c1-2-5-9(6-3-1)11-12-14-15(13-11)10-7-4-8-16-10/h1-8H
InChIKeyLAWJDVRMWVCZQP-UHFFFAOYSA-N
XLogP1.92
TPSA56.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-ethylphenyl)-5-phenyltetrazole
CID 23606527
2-(2,3-dimethylphenyl)-5-phenyltetrazole
CID 54119212
2-[2-(bromomethyl)phenyl]-5-phenyltetrazole
CID 107085646
5-(4-bromophenyl)-2-phenyltetrazole
CID 11370072
[2-(5-phenyltetrazol-2-yl)-4-pyridinyl]methanamine
CID 62293246
1-[4-(5-phenyltetrazol-2-yl)phenyl]ethanol
CID 43506228
3-(5-phenyltetrazol-2-yl)benzoic acid
CID 63941692
[3,5-difluoro-4-(5-phenyltetrazol-2-yl)phenyl]methanol
CID 63076359
3-(5-phenyltetrazol-2-yl)pyridazine-4-carboxylic acid
CID 80517200
[3,5-difluoro-4-(5-phenyltetrazol-2-yl)phenyl]methanamine
CID 63078222
5-(chloromethyl)-2-(5-phenyltetrazol-2-yl)pyridine
CID 61257439
[3-[(5-phenyltetrazol-2-yl)methyl]furan-2-yl]methanamine
CID 62448659

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-5-phenyltetrazole?
The IUPAC name of 2-(furan-2-yl)-5-phenyltetrazole (CID 66611423) is 2-(furan-2-yl)-5-phenyltetrazole.
What is the SMILES notation for 2-(furan-2-yl)-5-phenyltetrazole?
The canonical SMILES for 2-(furan-2-yl)-5-phenyltetrazole is c1ccc(-c2nnn(-c3ccco3)n2)cc1.
What is the InChIKey of 2-(furan-2-yl)-5-phenyltetrazole?
The InChIKey is LAWJDVRMWVCZQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4O/c1-2-5-9(6-3-1)11-12-14-15(13-11)10-7-4-8-16-10/h1-8H.
What are the key properties of 2-(furan-2-yl)-5-phenyltetrazole?
2-(furan-2-yl)-5-phenyltetrazole has a molecular weight of 212.21 g/mol, XLogP of 1.92, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-5-phenyltetrazole is sourced from PubChem (CID 66611423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).