1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol

C19H23FN2O — CID 11674053

IUPAC1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol
SMILESCNCC(O)C(c1cccc(F)c1)N1c2ccccc2CC1C
InChIInChI=1S/C19H23FN2O/c1-13-10-14-6-3-4-9-17(14)22(13)19(18(23)12-21-2)15-7-5-8-16(20)11-15/h3-9,11,13,18-19,21,23H,10,12H2,1-2H3
InChIKeyLXDDMNMCPHMWJN-UHFFFAOYSA-N
MW314.40 g/mol
LogP2.90
Rot. Bonds5

About 1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol

1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol (PubChem CID 11674053) has the molecular formula C19H23FN2O and a molecular weight of 314.40 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol
PubChem CID11674053
Molecular FormulaC19H23FN2O
Molecular Weight314.40 g/mol
Exact Mass314.18
IUPAC Name1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol
SMILESCNCC(O)C(c1cccc(F)c1)N1c2ccccc2CC1C
InChIInChI=1S/C19H23FN2O/c1-13-10-14-6-3-4-9-17(14)22(13)19(18(23)12-21-2)15-7-5-8-16(20)11-15/h3-9,11,13,18-19,21,23H,10,12H2,1-2H3
InChIKeyLXDDMNMCPHMWJN-UHFFFAOYSA-N
XLogP2.90
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol?
The IUPAC name of 1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol (CID 11674053) is 1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol.
What is the SMILES notation for 1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol?
The canonical SMILES for 1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol is CNCC(O)C(c1cccc(F)c1)N1c2ccccc2CC1C.
What is the InChIKey of 1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol?
The InChIKey is LXDDMNMCPHMWJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O/c1-13-10-14-6-3-4-9-17(14)22(13)19(18(23)12-21-2)15-7-5-8-16(20)11-15/h3-9,11,13,18-19,21,23H,10,12H2,1-2H3.
What are the key properties of 1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol?
1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol has a molecular weight of 314.40 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-3-(methylamino)-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol is sourced from PubChem (CID 11674053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).