2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine

C18H24N2 — CID 81216311

IUPAC2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine
SMILESCc1ccc2cc(C3(N)CC(C)CCC3C)ccc2n1
InChIInChI=1S/C18H24N2/c1-12-4-5-13(2)18(19,11-12)16-8-9-17-15(10-16)7-6-14(3)20-17/h6-10,12-13H,4-5,11,19H2,1-3H3
InChIKeyFVWARPUEWGQXRH-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.15
Rot. Bonds1

About 2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine

2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine (PubChem CID 81216311) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine
PubChem CID81216311
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine
SMILESCc1ccc2cc(C3(N)CC(C)CCC3C)ccc2n1
InChIInChI=1S/C18H24N2/c1-12-4-5-13(2)18(19,11-12)16-8-9-17-15(10-16)7-6-14(3)20-17/h6-10,12-13H,4-5,11,19H2,1-3H3
InChIKeyFVWARPUEWGQXRH-UHFFFAOYSA-N
XLogP4.15
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine?
The IUPAC name of 2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine (CID 81216311) is 2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine.
What is the SMILES notation for 2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine?
The canonical SMILES for 2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine is Cc1ccc2cc(C3(N)CC(C)CCC3C)ccc2n1.
What is the InChIKey of 2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine?
The InChIKey is FVWARPUEWGQXRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-12-4-5-13(2)18(19,11-12)16-8-9-17-15(10-16)7-6-14(3)20-17/h6-10,12-13H,4-5,11,19H2,1-3H3.
What are the key properties of 2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine?
2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine has a molecular weight of 268.40 g/mol, XLogP of 4.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1-(2-methylquinolin-6-yl)cyclohexan-1-amine is sourced from PubChem (CID 81216311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).