[4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine

C15H19FN2O — CID 82278363

IUPAC[4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine
SMILESCn1cc(C2(CN)CCOCC2)c2ccc(F)cc21
InChIInChI=1S/C15H19FN2O/c1-18-9-13(12-3-2-11(16)8-14(12)18)15(10-17)4-6-19-7-5-15/h2-3,8-9H,4-7,10,17H2,1H3
InChIKeyOWYGXTNQRVGBKQ-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.32
Rot. Bonds2

About [4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine

[4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine (PubChem CID 82278363) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is [4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine.

Molecular Properties

Compound Name[4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine
PubChem CID82278363
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name[4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine
SMILESCn1cc(C2(CN)CCOCC2)c2ccc(F)cc21
InChIInChI=1S/C15H19FN2O/c1-18-9-13(12-3-2-11(16)8-14(12)18)15(10-17)4-6-19-7-5-15/h2-3,8-9H,4-7,10,17H2,1H3
InChIKeyOWYGXTNQRVGBKQ-UHFFFAOYSA-N
XLogP2.32
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(5-fluoro-1-methylindol-3-yl)cyclopropyl]methanamine
CID 82278328
1-[1-(6-fluoro-1-methylindol-3-yl)cyclopropyl]-N-methylmethanamine
CID 84627003
[1-(1-methylindol-3-yl)cyclopropyl]methanamine
CID 82278323
[1-(5-methyl-[1,3]dioxolo[4,5-f]indol-7-yl)cyclopropyl]methanamine
CID 82497562
6-fluoro-1-methyl-3-propan-2-ylindole
CID 58525499
4-[3-(6-fluoro-1-methylindol-3-yl)propyl]morpholine
CID 170871004
[4-(1-cyclopropyl-6-fluorobenzimidazol-2-yl)oxan-4-yl]methanamine
CID 115438879
[1-(5-ethyl-1-methylindol-3-yl)cyclopentyl]methanamine
CID 82278342
3-chloro-6-fluoro-1-methylindole
CID 153370485
3-(6-fluoro-1-methylindol-3-yl)-3-methylbutan-1-amine
CID 84627862
1-(2,4-difluorophenyl)-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea
CID 54003214
[4-(4-chloro-2-methylphenyl)oxan-4-yl]methanamine
CID 83824742

Frequently Asked Questions

What is the IUPAC name of [4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine?
The IUPAC name of [4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine (CID 82278363) is [4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine.
What is the SMILES notation for [4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine?
The canonical SMILES for [4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine is Cn1cc(C2(CN)CCOCC2)c2ccc(F)cc21.
What is the InChIKey of [4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine?
The InChIKey is OWYGXTNQRVGBKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c1-18-9-13(12-3-2-11(16)8-14(12)18)15(10-17)4-6-19-7-5-15/h2-3,8-9H,4-7,10,17H2,1H3.
What are the key properties of [4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine?
[4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine has a molecular weight of 262.33 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(6-fluoro-1-methylindol-3-yl)oxan-4-yl]methanamine is sourced from PubChem (CID 82278363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).