5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen

C19H29FN2O — CID 161412318

IUPAC5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen
SMILESC[C@H](CN1CCC2(CC1)CNc1ccc(F)cc12)[C@H]1CCCO1.[H][H]
InChIInChI=1S/C19H27FN2O.H2/c1-14(18-3-2-10-23-18)12-22-8-6-19(7-9-22)13-21-17-5-4-15(20)11-16(17)19;/h4-5,11,14,18,21H,2-3,6-10,12-13H2,1H3;1H/t14-,18-;/m1./s1
InChIKeyVVQBPPDGFHWRDN-KEZWHQCISA-N
MW320.45 g/mol
LogP3.65
Rot. Bonds3

About 5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen

5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen (PubChem CID 161412318) has the molecular formula C19H29FN2O and a molecular weight of 320.45 g/mol. Its IUPAC name is 5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen.

Molecular Properties

Compound Name5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen
PubChem CID161412318
Molecular FormulaC19H29FN2O
Molecular Weight320.45 g/mol
Exact Mass320.23
IUPAC Name5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen
SMILESC[C@H](CN1CCC2(CC1)CNc1ccc(F)cc12)[C@H]1CCCO1.[H][H]
InChIInChI=1S/C19H27FN2O.H2/c1-14(18-3-2-10-23-18)12-22-8-6-19(7-9-22)13-21-17-5-4-15(20)11-16(17)19;/h4-5,11,14,18,21H,2-3,6-10,12-13H2,1H3;1H/t14-,18-;/m1./s1
InChIKeyVVQBPPDGFHWRDN-KEZWHQCISA-N
XLogP3.65
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.45
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen with MolForge

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Related Compounds

5-fluoro-1'-[[(6R,7R)-2-oxabicyclo[4.2.0]octan-7-yl]methyl]spiro[1,2-dihydroindole-3,4'-piperidine]
CID 70959431
5-fluoro-1'-(4-methylcycloheptyl)spiro[1,2-dihydroindole-3,4'-piperidine]
CID 70957597
1'-[(E)-3-(4-chlorophenyl)prop-2-enyl]-5-fluorospiro[1,2-dihydroindole-3,4'-piperidine]
CID 58046534
5-fluoro-1'-(3-methyl-6-methylidenecycloheptyl)spiro[1,2-dihydroindole-3,4'-piperidine]
CID 88979905
1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]
CID 70957527
5-fluorospiro[1,2-dihydroindole-3,2'-oxetane]
CID 171545165
5-fluoro-1-[1-(oxolan-2-yl)ethyl]benzimidazol-2-amine
CID 43662119
4',4'-difluoro-5-methoxyspiro[1,2-dihydroindole-3,1'-cyclohexane]
CID 106701810
4-chloro-N-[4-(5-fluorospiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl)-2-phenylbutyl]-N-methylbenzenesulfonamide
CID 143074133
6-fluorospiro[1,2-dihydroindole-3,1'-cyclohexane]
CID 115024124
[4-[(2S)-2-(4-fluorophenyl)-2-hydroxyethyl]piperazin-1-yl]-[(2S)-oxolan-2-yl]methanone
CID 32513873
5-fluoro-3-propan-2-yl-3-propyl-1,2-dihydroindole
CID 106701934

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen?
The IUPAC name of 5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen (CID 161412318) is 5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen.
What is the SMILES notation for 5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen?
The canonical SMILES for 5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen is C[C@H](CN1CCC2(CC1)CNc1ccc(F)cc12)[C@H]1CCCO1.[H][H].
What is the InChIKey of 5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen?
The InChIKey is VVQBPPDGFHWRDN-KEZWHQCISA-N. The full InChI is InChI=1S/C19H27FN2O.H2/c1-14(18-3-2-10-23-18)12-22-8-6-19(7-9-22)13-21-17-5-4-15(20)11-16(17)19;/h4-5,11,14,18,21H,2-3,6-10,12-13H2,1H3;1H/t14-,18-;/m1./s1.
What are the key properties of 5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen?
5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen has a molecular weight of 320.45 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1'-[(2R)-2-[(2R)-oxolan-2-yl]propyl]spiro[1,2-dihydroindole-3,4'-piperidine];molecular hydrogen is sourced from PubChem (CID 161412318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).