6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole

C16H23FN2 — CID 103497238

IUPAC6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole
SMILESCCCC1(CN2CCc3ccc(F)cc32)CCNC1
InChIInChI=1S/C16H23FN2/c1-2-6-16(7-8-18-11-16)12-19-9-5-13-3-4-14(17)10-15(13)19/h3-4,10,18H,2,5-9,11-12H2,1H3
InChIKeyFSYVOMSWEHDYOX-UHFFFAOYSA-N
MW262.37 g/mol
LogP2.97
Rot. Bonds4

About 6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole

6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole (PubChem CID 103497238) has the molecular formula C16H23FN2 and a molecular weight of 262.37 g/mol. Its IUPAC name is 6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole.

Molecular Properties

Compound Name6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole
PubChem CID103497238
Molecular FormulaC16H23FN2
Molecular Weight262.37 g/mol
Exact Mass262.18
IUPAC Name6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole
SMILESCCCC1(CN2CCc3ccc(F)cc32)CCNC1
InChIInChI=1S/C16H23FN2/c1-2-6-16(7-8-18-11-16)12-19-9-5-13-3-4-14(17)10-15(13)19/h3-4,10,18H,2,5-9,11-12H2,1H3
InChIKeyFSYVOMSWEHDYOX-UHFFFAOYSA-N
XLogP2.97
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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
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
4-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-4-methyloxolan-3-amine
CID 103497186
4-(6-fluoro-2,3-dihydroindol-1-yl)butane-1-thiol
CID 103504365
4-(6-fluoro-2,3-dihydroindol-1-yl)-N-methylbutan-1-amine
CID 103497056
5-(6-fluoro-2,3-dihydroindol-1-yl)-N-methylpentan-1-amine
CID 103503121
N-ethyl-3-(6-fluoro-2,3-dihydroindol-1-yl)propan-1-amine
CID 103494949
4-(6-fluoro-2,3-dihydroindol-1-yl)-N-propylbutan-2-amine
CID 103494946
6-fluoro-1-(1H-imidazol-2-ylmethyl)-2,3-dihydroindole
CID 59556823
2-[(6-fluoro-2,3-dihydroindol-1-yl)methyl]-2-methyl-N-propan-2-ylpentan-1-amine
CID 103502593

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole?
The IUPAC name of 6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole (CID 103497238) is 6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole.
What is the SMILES notation for 6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole?
The canonical SMILES for 6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole is CCCC1(CN2CCc3ccc(F)cc32)CCNC1.
What is the InChIKey of 6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole?
The InChIKey is FSYVOMSWEHDYOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2/c1-2-6-16(7-8-18-11-16)12-19-9-5-13-3-4-14(17)10-15(13)19/h3-4,10,18H,2,5-9,11-12H2,1H3.
What are the key properties of 6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole?
6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole has a molecular weight of 262.37 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1-[(3-propylpyrrolidin-3-yl)methyl]-2,3-dihydroindole is sourced from PubChem (CID 103497238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).