1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline

C14H21N — CID 141033194

IUPAC1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline
SMILESCC(C)c1ccc2c(c1)N(C)C(C)CC2
InChIInChI=1S/C14H21N/c1-10(2)13-8-7-12-6-5-11(3)15(4)14(12)9-13/h7-11H,5-6H2,1-4H3
InChIKeyJXYWIZXPGOFHIY-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.58
Rot. Bonds1

About 1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline

1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline (PubChem CID 141033194) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline.

Molecular Properties

Compound Name1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline
PubChem CID141033194
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline
SMILESCC(C)c1ccc2c(c1)N(C)C(C)CC2
InChIInChI=1S/C14H21N/c1-10(2)13-8-7-12-6-5-11(3)15(4)14(12)9-13/h7-11H,5-6H2,1-4H3
InChIKeyJXYWIZXPGOFHIY-UHFFFAOYSA-N
XLogP3.58
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline?
The IUPAC name of 1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline (CID 141033194) is 1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline.
What is the SMILES notation for 1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline?
The canonical SMILES for 1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline is CC(C)c1ccc2c(c1)N(C)C(C)CC2.
What is the InChIKey of 1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline?
The InChIKey is JXYWIZXPGOFHIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-10(2)13-8-7-12-6-5-11(3)15(4)14(12)9-13/h7-11H,5-6H2,1-4H3.
What are the key properties of 1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline?
1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline has a molecular weight of 203.33 g/mol, XLogP of 3.58, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline is sourced from PubChem (CID 141033194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).