(1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol

C17H19NO — CID 103959688

IUPAC(1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol
SMILESCC[C@H](O)c1ccccc1N1CCc2ccccc21
InChIInChI=1S/C17H19NO/c1-2-17(19)14-8-4-6-10-16(14)18-12-11-13-7-3-5-9-15(13)18/h3-10,17,19H,2,11-12H2,1H3/t17-/m0/s1
InChIKeyQVTFQWCMNQKSGA-KRWDZBQOSA-N
MW253.35 g/mol
LogP3.82
Rot. Bonds3

About (1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol

(1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol (PubChem CID 103959688) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is (1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol.

Molecular Properties

Compound Name(1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol
PubChem CID103959688
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name(1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol
SMILESCC[C@H](O)c1ccccc1N1CCc2ccccc21
InChIInChI=1S/C17H19NO/c1-2-17(19)14-8-4-6-10-16(14)18-12-11-13-7-3-5-9-15(13)18/h3-10,17,19H,2,11-12H2,1H3/t17-/m0/s1
InChIKeyQVTFQWCMNQKSGA-KRWDZBQOSA-N
XLogP3.82
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-[2-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]propan-1-ol
CID 103498371
(1R)-1-[2-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)phenyl]propan-1-ol
CID 103960202
1-[2-(2,3-dihydroindol-1-yl)phenyl]-N-methylpropan-1-amine
CID 115994813
(1S)-1-[2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)phenyl]propan-1-ol
CID 103960120
(1R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)phenyl]ethanol
CID 55182824
(1R)-1-(2-piperidin-1-ylphenyl)propan-1-ol
CID 103959701
1-[6-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-3-pyridinyl]propan-1-ol
CID 102545827
(1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol
CID 103959670
(1S)-1-[2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)phenyl]propan-1-ol
CID 103960137
1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-one
CID 86070231
(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)phenyl]propan-1-ol
CID 113358948
(1S)-1-[2-(2-methylazepan-1-yl)phenyl]propan-1-ol
CID 103960186

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol?
The IUPAC name of (1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol (CID 103959688) is (1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol.
What is the SMILES notation for (1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol?
The canonical SMILES for (1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol is CC[C@H](O)c1ccccc1N1CCc2ccccc21.
What is the InChIKey of (1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol?
The InChIKey is QVTFQWCMNQKSGA-KRWDZBQOSA-N. The full InChI is InChI=1S/C17H19NO/c1-2-17(19)14-8-4-6-10-16(14)18-12-11-13-7-3-5-9-15(13)18/h3-10,17,19H,2,11-12H2,1H3/t17-/m0/s1.
What are the key properties of (1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol?
(1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol has a molecular weight of 253.35 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol is sourced from PubChem (CID 103959688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).