7-methyl-7a,8-dihydrocyclopropa[e]quinoline

C11H11N — CID 142233483

IUPAC7-methyl-7a,8-dihydrocyclopropa[e]quinoline
SMILESCC1=CC=C2N=CC=CC23CC13
InChIInChI=1S/C11H11N/c1-8-3-4-10-11(7-9(8)11)5-2-6-12-10/h2-6,9H,7H2,1H3
InChIKeyWNGMPTOZPLBHMK-UHFFFAOYSA-N
MW157.22 g/mol
LogP2.48
Rot. Bonds

About 7-methyl-7a,8-dihydrocyclopropa[e]quinoline

7-methyl-7a,8-dihydrocyclopropa[e]quinoline (PubChem CID 142233483) has the molecular formula C11H11N and a molecular weight of 157.22 g/mol. Its IUPAC name is 7-methyl-7a,8-dihydrocyclopropa[e]quinoline.

Molecular Properties

Compound Name7-methyl-7a,8-dihydrocyclopropa[e]quinoline
PubChem CID142233483
Molecular FormulaC11H11N
Molecular Weight157.22 g/mol
Exact Mass157.09
IUPAC Name7-methyl-7a,8-dihydrocyclopropa[e]quinoline
SMILESCC1=CC=C2N=CC=CC23CC13
InChIInChI=1S/C11H11N/c1-8-3-4-10-11(7-9(8)11)5-2-6-12-10/h2-6,9H,7H2,1H3
InChIKeyWNGMPTOZPLBHMK-UHFFFAOYSA-N
XLogP2.48
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-7a,8-dihydrocyclopropa[e]quinoline?
The IUPAC name of 7-methyl-7a,8-dihydrocyclopropa[e]quinoline (CID 142233483) is 7-methyl-7a,8-dihydrocyclopropa[e]quinoline.
What is the SMILES notation for 7-methyl-7a,8-dihydrocyclopropa[e]quinoline?
The canonical SMILES for 7-methyl-7a,8-dihydrocyclopropa[e]quinoline is CC1=CC=C2N=CC=CC23CC13.
What is the InChIKey of 7-methyl-7a,8-dihydrocyclopropa[e]quinoline?
The InChIKey is WNGMPTOZPLBHMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N/c1-8-3-4-10-11(7-9(8)11)5-2-6-12-10/h2-6,9H,7H2,1H3.
What are the key properties of 7-methyl-7a,8-dihydrocyclopropa[e]quinoline?
7-methyl-7a,8-dihydrocyclopropa[e]quinoline has a molecular weight of 157.22 g/mol, XLogP of 2.48, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-7a,8-dihydrocyclopropa[e]quinoline is sourced from PubChem (CID 142233483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).