2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline

C14H19N — CID 126663737

IUPAC2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline
SMILESC=C(C)N1c2c(C)cccc2CCC1C
InChIInChI=1S/C14H19N/c1-10(2)15-12(4)8-9-13-7-5-6-11(3)14(13)15/h5-7,12H,1,8-9H2,2-4H3
InChIKeyYFEROZJMLYSYCL-UHFFFAOYSA-N
MW201.31 g/mol
LogP3.67
Rot. Bonds1

About 2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline

2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline (PubChem CID 126663737) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is 2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline.

Molecular Properties

Compound Name2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline
PubChem CID126663737
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC Name2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline
SMILESC=C(C)N1c2c(C)cccc2CCC1C
InChIInChI=1S/C14H19N/c1-10(2)15-12(4)8-9-13-7-5-6-11(3)14(13)15/h5-7,12H,1,8-9H2,2-4H3
InChIKeyYFEROZJMLYSYCL-UHFFFAOYSA-N
XLogP3.67
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline?
The IUPAC name of 2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline (CID 126663737) is 2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline.
What is the SMILES notation for 2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline?
The canonical SMILES for 2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline is C=C(C)N1c2c(C)cccc2CCC1C.
What is the InChIKey of 2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline?
The InChIKey is YFEROZJMLYSYCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-10(2)15-12(4)8-9-13-7-5-6-11(3)14(13)15/h5-7,12H,1,8-9H2,2-4H3.
What are the key properties of 2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline?
2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline has a molecular weight of 201.31 g/mol, XLogP of 3.67, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-dimethyl-1-prop-1-en-2-yl-3,4-dihydro-2H-quinoline is sourced from PubChem (CID 126663737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).