(1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol

C17H17NO — CID 82758235

IUPAC(1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol
SMILESCC[C@H](O)c1c(-c2ccccc2)[nH]c2ccccc12
InChIInChI=1S/C17H17NO/c1-2-15(19)16-13-10-6-7-11-14(13)18-17(16)12-8-4-3-5-9-12/h3-11,15,18-19H,2H2,1H3/t15-/m0/s1
InChIKeyURIADQAPPVACCO-HNNXBMFYSA-N
MW251.33 g/mol
LogP4.28
Rot. Bonds3

About (1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol

(1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol (PubChem CID 82758235) has the molecular formula C17H17NO and a molecular weight of 251.33 g/mol. Its IUPAC name is (1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol.

Molecular Properties

Compound Name(1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol
PubChem CID82758235
Molecular FormulaC17H17NO
Molecular Weight251.33 g/mol
Exact Mass251.13
IUPAC Name(1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol
SMILESCC[C@H](O)c1c(-c2ccccc2)[nH]c2ccccc12
InChIInChI=1S/C17H17NO/c1-2-15(19)16-13-10-6-7-11-14(13)18-17(16)12-8-4-3-5-9-12/h3-11,15,18-19H,2H2,1H3/t15-/m0/s1
InChIKeyURIADQAPPVACCO-HNNXBMFYSA-N
XLogP4.28
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

3-bromo-1-(2-phenyl-1H-indol-3-yl)propane-1,2-diol
CID 171861369
9H-carbazole;propane-1,1-diol
CID 19846299
1-(9H-carbazol-3-yl)propan-1-ol
CID 61087342
(S)-(2-phenyl-1H-indol-3-yl)-pyridin-4-ylmethanol
CID 7150227
methyl (2R)-2-(2-phenyl-1H-indol-3-yl)propanoate
CID 146165176
1,1,1-trifluoro-3-phenyl-3-(2-phenyl-1H-indol-3-yl)propan-2-ol
CID 155547914
bis(9H-carbazole);propane
CID 90987002
9H-carbazole;9,10-diphenylanthracene
CID 159841164
[2-phenyl-2-(2-phenyl-1H-indol-3-yl)ethyl]urea
CID 118908898
9H-carbazole;propanoic acid
CID 68841226
1-(2-phenyl-1H-indol-3-yl)propan-2-one
CID 83780172
1-(2-methyl-1H-indol-3-yl)-2-sulfanylethanol
CID 116830002

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol?
The IUPAC name of (1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol (CID 82758235) is (1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol.
What is the SMILES notation for (1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol?
The canonical SMILES for (1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol is CC[C@H](O)c1c(-c2ccccc2)[nH]c2ccccc12.
What is the InChIKey of (1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol?
The InChIKey is URIADQAPPVACCO-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H17NO/c1-2-15(19)16-13-10-6-7-11-14(13)18-17(16)12-8-4-3-5-9-12/h3-11,15,18-19H,2H2,1H3/t15-/m0/s1.
What are the key properties of (1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol?
(1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol has a molecular weight of 251.33 g/mol, XLogP of 4.28, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(2-phenyl-1H-indol-3-yl)propan-1-ol is sourced from PubChem (CID 82758235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).