[4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine

C15H19FN2O — CID 82278444

IUPAC[4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine
SMILESCc1[nH]c2c(F)cccc2c1C1(CN)CCOCC1
InChIInChI=1S/C15H19FN2O/c1-10-13(15(9-17)5-7-19-8-6-15)11-3-2-4-12(16)14(11)18-10/h2-4,18H,5-9,17H2,1H3
InChIKeyFIWQTMMAKGXOLK-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.62
Rot. Bonds2

About [4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine

[4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine (PubChem CID 82278444) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is [4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine.

Molecular Properties

Compound Name[4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine
PubChem CID82278444
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name[4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine
SMILESCc1[nH]c2c(F)cccc2c1C1(CN)CCOCC1
InChIInChI=1S/C15H19FN2O/c1-10-13(15(9-17)5-7-19-8-6-15)11-3-2-4-12(16)14(11)18-10/h2-4,18H,5-9,17H2,1H3
InChIKeyFIWQTMMAKGXOLK-UHFFFAOYSA-N
XLogP2.62
TPSA51.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine?
The IUPAC name of [4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine (CID 82278444) is [4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine.
What is the SMILES notation for [4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine?
The canonical SMILES for [4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine is Cc1[nH]c2c(F)cccc2c1C1(CN)CCOCC1.
What is the InChIKey of [4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine?
The InChIKey is FIWQTMMAKGXOLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c1-10-13(15(9-17)5-7-19-8-6-15)11-3-2-4-12(16)14(11)18-10/h2-4,18H,5-9,17H2,1H3.
What are the key properties of [4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine?
[4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine has a molecular weight of 262.33 g/mol, XLogP of 2.62, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(7-fluoro-2-methyl-1H-indol-3-yl)oxan-4-yl]methanamine is sourced from PubChem (CID 82278444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).