7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole

C11H10FNO — CID 122666941

IUPAC7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole
SMILESFc1ccc2cc3n(c2c1)CCOC3
InChIInChI=1S/C11H10FNO/c12-9-2-1-8-5-10-7-14-4-3-13(10)11(8)6-9/h1-2,5-6H,3-4,7H2
InChIKeyIVAJRTKIWYMXDK-UHFFFAOYSA-N
MW191.21 g/mol
LogP2.31
Rot. Bonds

About 7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole

7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole (PubChem CID 122666941) has the molecular formula C11H10FNO and a molecular weight of 191.21 g/mol. Its IUPAC name is 7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole.

Molecular Properties

Compound Name7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole
PubChem CID122666941
Molecular FormulaC11H10FNO
Molecular Weight191.21 g/mol
Exact Mass191.07
IUPAC Name7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole
SMILESFc1ccc2cc3n(c2c1)CCOC3
InChIInChI=1S/C11H10FNO/c12-9-2-1-8-5-10-7-14-4-3-13(10)11(8)6-9/h1-2,5-6H,3-4,7H2
InChIKeyIVAJRTKIWYMXDK-UHFFFAOYSA-N
XLogP2.31
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.21
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole?
The IUPAC name of 7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole (CID 122666941) is 7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole.
What is the SMILES notation for 7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole?
The canonical SMILES for 7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole is Fc1ccc2cc3n(c2c1)CCOC3.
What is the InChIKey of 7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole?
The InChIKey is IVAJRTKIWYMXDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNO/c12-9-2-1-8-5-10-7-14-4-3-13(10)11(8)6-9/h1-2,5-6H,3-4,7H2.
What are the key properties of 7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole?
7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole has a molecular weight of 191.21 g/mol, XLogP of 2.31, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indole is sourced from PubChem (CID 122666941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).