2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane

C14H19N — CID 142225187

IUPAC2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane
SMILESCC.Cc1cc(C)c2c(n1)=CC1CC1C=2
InChIInChI=1S/C12H13N.C2H6/c1-7-3-8(2)13-12-6-10-4-9(10)5-11(7)12;1-2/h3,5-6,9-10H,4H2,1-2H3;1-2H3
InChIKeyMOGIJFQLYARLAQ-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.94
Rot. Bonds

About 2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane

2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane (PubChem CID 142225187) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane.

Molecular Properties

Compound Name2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane
PubChem CID142225187
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane
SMILESCC.Cc1cc(C)c2c(n1)=CC1CC1C=2
InChIInChI=1S/C12H13N.C2H6/c1-7-3-8(2)13-12-6-10-4-9(10)5-11(7)12;1-2/h3,5-6,9-10H,4H2,1-2H3;1-2H3
InChIKeyMOGIJFQLYARLAQ-UHFFFAOYSA-N
XLogP1.94
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane?
The IUPAC name of 2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane (CID 142225187) is 2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane.
What is the SMILES notation for 2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane?
The canonical SMILES for 2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane is CC.Cc1cc(C)c2c(n1)=CC1CC1C=2.
What is the InChIKey of 2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane?
The InChIKey is MOGIJFQLYARLAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N.C2H6/c1-7-3-8(2)13-12-6-10-4-9(10)5-11(7)12;1-2/h3,5-6,9-10H,4H2,1-2H3;1-2H3.
What are the key properties of 2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane?
2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane has a molecular weight of 201.31 g/mol, XLogP of 1.94, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-6,6a-dihydro-5aH-cyclopropa[g]quinoline;ethane is sourced from PubChem (CID 142225187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).