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

C18H21NO — CID 103959670

IUPAC(1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol
SMILESCC[C@H](O)c1ccccc1N1c2ccccc2CC1C
InChIInChI=1S/C18H21NO/c1-3-18(20)15-9-5-7-11-17(15)19-13(2)12-14-8-4-6-10-16(14)19/h4-11,13,18,20H,3,12H2,1-2H3/t13?,18-/m0/s1
InChIKeyUAHIPZZGFMLRPU-UWBLVGDVSA-N
MW267.37 g/mol
LogP4.21
Rot. Bonds3

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

(1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol (PubChem CID 103959670) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is (1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol.

Molecular Properties

Compound Name(1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol
PubChem CID103959670
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name(1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol
SMILESCC[C@H](O)c1ccccc1N1c2ccccc2CC1C
InChIInChI=1S/C18H21NO/c1-3-18(20)15-9-5-7-11-17(15)19-13(2)12-14-8-4-6-10-16(14)19/h4-11,13,18,20H,3,12H2,1-2H3/t13?,18-/m0/s1
InChIKeyUAHIPZZGFMLRPU-UWBLVGDVSA-N
XLogP4.21
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]ethanol
CID 43510148
(1R)-1-[2-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)phenyl]propan-1-ol
CID 103960202
(1R)-1-[2-[4-(2-methylpropyl)piperazin-1-yl]phenyl]propan-1-ol
CID 103960079
(1R)-1-[2-(2,5-dimethylmorpholin-4-yl)phenyl]propan-1-ol
CID 113358942
(1R)-1-(2-piperidin-1-ylphenyl)propan-1-ol
CID 103959701
(1S)-1-[2-(2,3-dihydroindol-1-yl)phenyl]propan-1-ol
CID 103959688
1-[2-[4-(1-hydroxyethyl)piperidin-1-yl]phenyl]propan-1-ol
CID 106836517
1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-ol
CID 62044766
(1S)-1-[2-fluoro-6-(2-methyl-2,3-dihydroindol-1-yl)phenyl]ethanol
CID 78939271
(1S)-1-[2-[4-(dimethylamino)piperidin-1-yl]phenyl]propan-1-ol
CID 103959777
(1S)-1-[2-(1,1-dioxo-1,4-thiazinan-4-yl)phenyl]propan-1-ol
CID 113358948
3-(2-methyl-2,3-dihydroindol-1-yl)-1-(2-methylphenyl)propan-1-ol
CID 62623099

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol?
The IUPAC name of (1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol (CID 103959670) is (1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol.
What is the SMILES notation for (1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol?
The canonical SMILES for (1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol is CC[C@H](O)c1ccccc1N1c2ccccc2CC1C.
What is the InChIKey of (1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol?
The InChIKey is UAHIPZZGFMLRPU-UWBLVGDVSA-N. The full InChI is InChI=1S/C18H21NO/c1-3-18(20)15-9-5-7-11-17(15)19-13(2)12-14-8-4-6-10-16(14)19/h4-11,13,18,20H,3,12H2,1-2H3/t13?,18-/m0/s1.
What are the key properties of (1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol?
(1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol has a molecular weight of 267.37 g/mol, XLogP of 4.21, 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-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol is sourced from PubChem (CID 103959670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).