6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane

C14H21N — CID 144851891

IUPAC6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane
SMILESC1=c2cccnc2=CC2CC12.CC.CC
InChIInChI=1S/C10H9N.2C2H6/c1-2-7-4-8-5-9(8)6-10(7)11-3-1;2*1-2/h1-4,6,8-9H,5H2;2*1-2H3
InChIKeyWFHXAXWYYIVWFY-UHFFFAOYSA-N
MW203.33 g/mol
LogP2.34
Rot. Bonds

About 6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane

6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane (PubChem CID 144851891) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane.

Molecular Properties

Compound Name6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane
PubChem CID144851891
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane
SMILESC1=c2cccnc2=CC2CC12.CC.CC
InChIInChI=1S/C10H9N.2C2H6/c1-2-7-4-8-5-9(8)6-10(7)11-3-1;2*1-2/h1-4,6,8-9H,5H2;2*1-2H3
InChIKeyWFHXAXWYYIVWFY-UHFFFAOYSA-N
XLogP2.34
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane?
The IUPAC name of 6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane (CID 144851891) is 6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane.
What is the SMILES notation for 6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane?
The canonical SMILES for 6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane is C1=c2cccnc2=CC2CC12.CC.CC.
What is the InChIKey of 6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane?
The InChIKey is WFHXAXWYYIVWFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N.2C2H6/c1-2-7-4-8-5-9(8)6-10(7)11-3-1;2*1-2/h1-4,6,8-9H,5H2;2*1-2H3.
What are the key properties of 6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane?
6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane has a molecular weight of 203.33 g/mol, XLogP of 2.34, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane is sourced from PubChem (CID 144851891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).