4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine

C14H19FN2O — CID 103497186

IUPAC4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine
SMILESCC1(CN2CCc3ccc(F)cc32)COCC1N
InChIInChI=1S/C14H19FN2O/c1-14(9-18-7-13(14)16)8-17-5-4-10-2-3-11(15)6-12(10)17/h2-3,6,13H,4-5,7-9,16H2,1H3
InChIKeyULFTWOLWPRWGBL-UHFFFAOYSA-N
MW250.32 g/mol
LogP1.55
Rot. Bonds2

About 4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine

4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine (PubChem CID 103497186) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is 4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine.

Molecular Properties

Compound Name4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine
PubChem CID103497186
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC Name4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine
SMILESCC1(CN2CCc3ccc(F)cc32)COCC1N
InChIInChI=1S/C14H19FN2O/c1-14(9-18-7-13(14)16)8-17-5-4-10-2-3-11(15)6-12(10)17/h2-3,6,13H,4-5,7-9,16H2,1H3
InChIKeyULFTWOLWPRWGBL-UHFFFAOYSA-N
XLogP1.55
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]oxan-4-yl]methyl]ethanamine
CID 103502519
[4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]oxan-4-yl]methanethiol
CID 103504369
2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-amine
CID 103497070
2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propylcyclohexan-1-amine
CID 103502594
2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 103502585
6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole
CID 103497238
4-(6-fluoro-2,3-dihydroindol-1-yl)butane-1-thiol
CID 103504365
7-fluoro-1-[(3-methylpyrrolidin-3-yl)methyl]-3,4-dihydro-2H-quinoline
CID 120902138
1-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]cyclohexane-1-carbaldehyde
CID 103502456
(E)-4-(6-fluoro-2,3-dihydroindol-1-yl)but-2-en-1-amine
CID 103495908
N-ethyl-3-(6-fluoro-2,3-dihydroindol-1-yl)propan-1-amine
CID 103494949
4-(2,5-dihydropyrrol-1-ylmethyl)-4-methyloxolan-3-amine
CID 131140835

Frequently Asked Questions

What is the IUPAC name of 4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine?
The IUPAC name of 4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine (CID 103497186) is 4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine.
What is the SMILES notation for 4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine?
The canonical SMILES for 4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine is CC1(CN2CCc3ccc(F)cc32)COCC1N.
What is the InChIKey of 4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine?
The InChIKey is ULFTWOLWPRWGBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c1-14(9-18-7-13(14)16)8-17-5-4-10-2-3-11(15)6-12(10)17/h2-3,6,13H,4-5,7-9,16H2,1H3.
What are the key properties of 4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine?
4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine has a molecular weight of 250.32 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine is sourced from PubChem (CID 103497186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).