5,6-dihydro-1H-indole;ethane

C10H15N — CID 144548243

IUPAC5,6-dihydro-1H-indole;ethane
SMILESC1=c2cc[nH]c2=CCC1.CC
InChIInChI=1S/C8H9N.C2H6/c1-2-4-8-7(3-1)5-6-9-8;1-2/h3-6,9H,1-2H2;1-2H3
InChIKeyWMRWKXNVLVHQRH-UHFFFAOYSA-N
MW149.24 g/mol
LogP1.40
Rot. Bonds

About 5,6-dihydro-1H-indole;ethane

5,6-dihydro-1H-indole;ethane (PubChem CID 144548243) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 5,6-dihydro-1H-indole;ethane.

Molecular Properties

Compound Name5,6-dihydro-1H-indole;ethane
PubChem CID144548243
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name5,6-dihydro-1H-indole;ethane
SMILESC1=c2cc[nH]c2=CCC1.CC
InChIInChI=1S/C8H9N.C2H6/c1-2-4-8-7(3-1)5-6-9-8;1-2/h3-6,9H,1-2H2;1-2H3
InChIKeyWMRWKXNVLVHQRH-UHFFFAOYSA-N
XLogP1.40
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 5,6-dihydro-1H-indole;ethane?
The IUPAC name of 5,6-dihydro-1H-indole;ethane (CID 144548243) is 5,6-dihydro-1H-indole;ethane.
What is the SMILES notation for 5,6-dihydro-1H-indole;ethane?
The canonical SMILES for 5,6-dihydro-1H-indole;ethane is C1=c2cc[nH]c2=CCC1.CC.
What is the InChIKey of 5,6-dihydro-1H-indole;ethane?
The InChIKey is WMRWKXNVLVHQRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N.C2H6/c1-2-4-8-7(3-1)5-6-9-8;1-2/h3-6,9H,1-2H2;1-2H3.
What are the key properties of 5,6-dihydro-1H-indole;ethane?
5,6-dihydro-1H-indole;ethane has a molecular weight of 149.24 g/mol, XLogP of 1.40, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydro-1H-indole;ethane is sourced from PubChem (CID 144548243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).