4-fluoro-1-(furan-2-ylmethyl)indole

C13H10FNO — CID 82793891

IUPAC4-fluoro-1-(furan-2-ylmethyl)indole
SMILESFc1cccc2c1ccn2Cc1ccco1
InChIInChI=1S/C13H10FNO/c14-12-4-1-5-13-11(12)6-7-15(13)9-10-3-2-8-16-10/h1-8H,9H2
InChIKeyNTDWNCWHQZEHOF-UHFFFAOYSA-N
MW215.23 g/mol
LogP3.42
Rot. Bonds2

About 4-fluoro-1-(furan-2-ylmethyl)indole

4-fluoro-1-(furan-2-ylmethyl)indole (PubChem CID 82793891) has the molecular formula C13H10FNO and a molecular weight of 215.23 g/mol. Its IUPAC name is 4-fluoro-1-(furan-2-ylmethyl)indole.

Molecular Properties

Compound Name4-fluoro-1-(furan-2-ylmethyl)indole
PubChem CID82793891
Molecular FormulaC13H10FNO
Molecular Weight215.23 g/mol
Exact Mass215.07
IUPAC Name4-fluoro-1-(furan-2-ylmethyl)indole
SMILESFc1cccc2c1ccn2Cc1ccco1
InChIInChI=1S/C13H10FNO/c14-12-4-1-5-13-11(12)6-7-15(13)9-10-3-2-8-16-10/h1-8H,9H2
InChIKeyNTDWNCWHQZEHOF-UHFFFAOYSA-N
XLogP3.42
TPSA18.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.23
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-1-(furan-2-ylmethyl)indole?
The IUPAC name of 4-fluoro-1-(furan-2-ylmethyl)indole (CID 82793891) is 4-fluoro-1-(furan-2-ylmethyl)indole.
What is the SMILES notation for 4-fluoro-1-(furan-2-ylmethyl)indole?
The canonical SMILES for 4-fluoro-1-(furan-2-ylmethyl)indole is Fc1cccc2c1ccn2Cc1ccco1.
What is the InChIKey of 4-fluoro-1-(furan-2-ylmethyl)indole?
The InChIKey is NTDWNCWHQZEHOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FNO/c14-12-4-1-5-13-11(12)6-7-15(13)9-10-3-2-8-16-10/h1-8H,9H2.
What are the key properties of 4-fluoro-1-(furan-2-ylmethyl)indole?
4-fluoro-1-(furan-2-ylmethyl)indole has a molecular weight of 215.23 g/mol, XLogP of 3.42, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-1-(furan-2-ylmethyl)indole is sourced from PubChem (CID 82793891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).