ethane;1H-indole;methane

C11H17N — CID 169425426

IUPACethane;1H-indole;methane
SMILESC.CC.c1ccc2[nH]ccc2c1
InChIInChI=1S/C8H7N.C2H6.CH4/c1-2-4-8-7(3-1)5-6-9-8;1-2;/h1-6,9H;1-2H3;1H4
InChIKeyGLWVTOSNINPDCD-UHFFFAOYSA-N
MW163.26 g/mol
LogP3.83
Rot. Bonds

About ethane;1H-indole;methane

ethane;1H-indole;methane (PubChem CID 169425426) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is ethane;1H-indole;methane.

Molecular Properties

Compound Nameethane;1H-indole;methane
PubChem CID169425426
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Nameethane;1H-indole;methane
SMILESC.CC.c1ccc2[nH]ccc2c1
InChIInChI=1S/C8H7N.C2H6.CH4/c1-2-4-8-7(3-1)5-6-9-8;1-2;/h1-6,9H;1-2H3;1H4
InChIKeyGLWVTOSNINPDCD-UHFFFAOYSA-N
XLogP3.83
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of ethane;1H-indole;methane?
The IUPAC name of ethane;1H-indole;methane (CID 169425426) is ethane;1H-indole;methane.
What is the SMILES notation for ethane;1H-indole;methane?
The canonical SMILES for ethane;1H-indole;methane is C.CC.c1ccc2[nH]ccc2c1.
What is the InChIKey of ethane;1H-indole;methane?
The InChIKey is GLWVTOSNINPDCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N.C2H6.CH4/c1-2-4-8-7(3-1)5-6-9-8;1-2;/h1-6,9H;1-2H3;1H4.
What are the key properties of ethane;1H-indole;methane?
ethane;1H-indole;methane has a molecular weight of 163.26 g/mol, XLogP of 3.83, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1H-indole;methane is sourced from PubChem (CID 169425426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).