1-(9H-fluoren-1-yl)tetrazole

C14H10N4 — CID 151624663

IUPAC1-(9H-fluoren-1-yl)tetrazole
SMILESc1ccc2c(c1)Cc1c-2cccc1-n1cnnn1
InChIInChI=1S/C14H10N4/c1-2-5-11-10(4-1)8-13-12(11)6-3-7-14(13)18-9-15-16-17-18/h1-7,9H,8H2
InChIKeyQPFSRGHEBRTSRB-UHFFFAOYSA-N
MW234.26 g/mol
LogP2.23
Rot. Bonds1

About 1-(9H-fluoren-1-yl)tetrazole

1-(9H-fluoren-1-yl)tetrazole (PubChem CID 151624663) has the molecular formula C14H10N4 and a molecular weight of 234.26 g/mol. Its IUPAC name is 1-(9H-fluoren-1-yl)tetrazole.

Molecular Properties

Compound Name1-(9H-fluoren-1-yl)tetrazole
PubChem CID151624663
Molecular FormulaC14H10N4
Molecular Weight234.26 g/mol
Exact Mass234.09
IUPAC Name1-(9H-fluoren-1-yl)tetrazole
SMILESc1ccc2c(c1)Cc1c-2cccc1-n1cnnn1
InChIInChI=1S/C14H10N4/c1-2-5-11-10(4-1)8-13-12(11)6-3-7-14(13)18-9-15-16-17-18/h1-7,9H,8H2
InChIKeyQPFSRGHEBRTSRB-UHFFFAOYSA-N
XLogP2.23
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(9H-fluoren-1-yl)tetrazole?
The IUPAC name of 1-(9H-fluoren-1-yl)tetrazole (CID 151624663) is 1-(9H-fluoren-1-yl)tetrazole.
What is the SMILES notation for 1-(9H-fluoren-1-yl)tetrazole?
The canonical SMILES for 1-(9H-fluoren-1-yl)tetrazole is c1ccc2c(c1)Cc1c-2cccc1-n1cnnn1.
What is the InChIKey of 1-(9H-fluoren-1-yl)tetrazole?
The InChIKey is QPFSRGHEBRTSRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4/c1-2-5-11-10(4-1)8-13-12(11)6-3-7-14(13)18-9-15-16-17-18/h1-7,9H,8H2.
What are the key properties of 1-(9H-fluoren-1-yl)tetrazole?
1-(9H-fluoren-1-yl)tetrazole has a molecular weight of 234.26 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-fluoren-1-yl)tetrazole is sourced from PubChem (CID 151624663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).