2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol

C17H19NO — CID 25407

IUPAC2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol
SMILESOCC(Cc1ccccc1)C1Cc2ccccc2N1
InChIInChI=1S/C17H19NO/c19-12-15(10-13-6-2-1-3-7-13)17-11-14-8-4-5-9-16(14)18-17/h1-9,15,17-19H,10-12H2
InChIKeySNEACLOTUAXVQM-UHFFFAOYSA-N
MW253.35 g/mol
LogP2.87
Rot. Bonds4

About 2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol

2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol (PubChem CID 25407) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol
PubChem CID25407
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol
SMILESOCC(Cc1ccccc1)C1Cc2ccccc2N1
InChIInChI=1S/C17H19NO/c19-12-15(10-13-6-2-1-3-7-13)17-11-14-8-4-5-9-16(14)18-17/h1-9,15,17-19H,10-12H2
InChIKeySNEACLOTUAXVQM-UHFFFAOYSA-N
XLogP2.87
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol?
The IUPAC name of 2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol (CID 25407) is 2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol is OCC(Cc1ccccc1)C1Cc2ccccc2N1.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol?
The InChIKey is SNEACLOTUAXVQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c19-12-15(10-13-6-2-1-3-7-13)17-11-14-8-4-5-9-16(14)18-17/h1-9,15,17-19H,10-12H2.
What are the key properties of 2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol?
2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol has a molecular weight of 253.35 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-2-yl)-3-phenylpropan-1-ol is sourced from PubChem (CID 25407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).