6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine

C16H26N2 — CID 106799282

IUPAC6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine
SMILESCCC(N)CCCN1CCCc2cc(C)ccc21
InChIInChI=1S/C16H26N2/c1-3-15(17)7-5-11-18-10-4-6-14-12-13(2)8-9-16(14)18/h8-9,12,15H,3-7,10-11,17H2,1-2H3
InChIKeyDBRXDUYDUCLDHO-UHFFFAOYSA-N
MW246.40 g/mol
LogP3.27
Rot. Bonds5

About 6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine

6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine (PubChem CID 106799282) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine.

Molecular Properties

Compound Name6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine
PubChem CID106799282
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine
SMILESCCC(N)CCCN1CCCc2cc(C)ccc21
InChIInChI=1S/C16H26N2/c1-3-15(17)7-5-11-18-10-4-6-14-12-13(2)8-9-16(14)18/h8-9,12,15H,3-7,10-11,17H2,1-2H3
InChIKeyDBRXDUYDUCLDHO-UHFFFAOYSA-N
XLogP3.27
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine?
The IUPAC name of 6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine (CID 106799282) is 6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine.
What is the SMILES notation for 6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine?
The canonical SMILES for 6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine is CCC(N)CCCN1CCCc2cc(C)ccc21.
What is the InChIKey of 6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine?
The InChIKey is DBRXDUYDUCLDHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-3-15(17)7-5-11-18-10-4-6-14-12-13(2)8-9-16(14)18/h8-9,12,15H,3-7,10-11,17H2,1-2H3.
What are the key properties of 6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine?
6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine has a molecular weight of 246.40 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine is sourced from PubChem (CID 106799282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).