3-phenyl-2,6-dihydro-1H-indole

C14H13N — CID 174710254

IUPAC3-phenyl-2,6-dihydro-1H-indole
SMILESC1=CC2=C(c3ccccc3)CNC2=CC1
InChIInChI=1S/C14H13N/c1-2-6-11(7-3-1)13-10-15-14-9-5-4-8-12(13)14/h1-4,6-9,15H,5,10H2
InChIKeyAPVFIAGSACUXND-UHFFFAOYSA-N
MW195.27 g/mol
LogP2.89
Rot. Bonds1

About 3-phenyl-2,6-dihydro-1H-indole

3-phenyl-2,6-dihydro-1H-indole (PubChem CID 174710254) has the molecular formula C14H13N and a molecular weight of 195.27 g/mol. Its IUPAC name is 3-phenyl-2,6-dihydro-1H-indole.

Molecular Properties

Compound Name3-phenyl-2,6-dihydro-1H-indole
PubChem CID174710254
Molecular FormulaC14H13N
Molecular Weight195.27 g/mol
Exact Mass195.10
IUPAC Name3-phenyl-2,6-dihydro-1H-indole
SMILESC1=CC2=C(c3ccccc3)CNC2=CC1
InChIInChI=1S/C14H13N/c1-2-6-11(7-3-1)13-10-15-14-9-5-4-8-12(13)14/h1-4,6-9,15H,5,10H2
InChIKeyAPVFIAGSACUXND-UHFFFAOYSA-N
XLogP2.89
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2-fluoro-4-[(2-phenyl-5H-inden-1-yl)methyl]pyridine
CID 174424106
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6-ethyl-4-phenyl-1,5-dihydropentalene
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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-2,6-dihydro-1H-indole?
The IUPAC name of 3-phenyl-2,6-dihydro-1H-indole (CID 174710254) is 3-phenyl-2,6-dihydro-1H-indole.
What is the SMILES notation for 3-phenyl-2,6-dihydro-1H-indole?
The canonical SMILES for 3-phenyl-2,6-dihydro-1H-indole is C1=CC2=C(c3ccccc3)CNC2=CC1.
What is the InChIKey of 3-phenyl-2,6-dihydro-1H-indole?
The InChIKey is APVFIAGSACUXND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N/c1-2-6-11(7-3-1)13-10-15-14-9-5-4-8-12(13)14/h1-4,6-9,15H,5,10H2.
What are the key properties of 3-phenyl-2,6-dihydro-1H-indole?
3-phenyl-2,6-dihydro-1H-indole has a molecular weight of 195.27 g/mol, XLogP of 2.89, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-2,6-dihydro-1H-indole is sourced from PubChem (CID 174710254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).