2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine

C18H24N2O — CID 105378639

IUPAC2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine
SMILESCc1ccc2cc(CNC3CCOC(C)(C)C3)ccc2n1
InChIInChI=1S/C18H24N2O/c1-13-4-6-15-10-14(5-7-17(15)20-13)12-19-16-8-9-21-18(2,3)11-16/h4-7,10,16,19H,8-9,11-12H2,1-3H3
InChIKeyZJMKTRXTZPGRIP-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.59
Rot. Bonds3

About 2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine

2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine (PubChem CID 105378639) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine
PubChem CID105378639
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine
SMILESCc1ccc2cc(CNC3CCOC(C)(C)C3)ccc2n1
InChIInChI=1S/C18H24N2O/c1-13-4-6-15-10-14(5-7-17(15)20-13)12-19-16-8-9-21-18(2,3)11-16/h4-7,10,16,19H,8-9,11-12H2,1-3H3
InChIKeyZJMKTRXTZPGRIP-UHFFFAOYSA-N
XLogP3.59
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-N-[(2-methylquinolin-6-yl)methyl]cyclohexane-1,4-diamine
CID 105378440
N-[(4-ethylphenyl)methyl]-2,2-dimethyloxan-4-amine
CID 115563697
2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]cyclopentan-1-amine
CID 105378566
N-[[4-(diethylamino)phenyl]methyl]-2,2-dimethyloxan-4-amine
CID 115563782
3-[[(2,2-dimethyloxan-4-yl)amino]methyl]benzoic acid
CID 103261138
N-[(3-fluoro-4-methoxyphenyl)methyl]-2,2-dimethyloxan-4-amine
CID 115563685
N-[(2-methylquinolin-6-yl)methyl]-1-(oxan-2-yl)methanamine
CID 105378407
6,6-dimethyl-5-[(2-methylquinolin-6-yl)methylamino]piperidin-2-one
CID 126805966
N-[(2,4-dimethylphenyl)methyl]-2,2-dimethyloxan-4-amine
CID 115563698
N-methyl-1-(2-methylquinolin-6-yl)methanamine
CID 81231391
2,2-dimethyl-N-[(4-propoxyphenyl)methyl]oxan-4-amine
CID 115563628
(3S)-N-[(2-methylquinolin-6-yl)methyl]-1-(2,2,2-trifluoroethyl)pyrrolidin-3-amine
CID 100642514

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine?
The IUPAC name of 2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine (CID 105378639) is 2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine.
What is the SMILES notation for 2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine?
The canonical SMILES for 2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine is Cc1ccc2cc(CNC3CCOC(C)(C)C3)ccc2n1.
What is the InChIKey of 2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine?
The InChIKey is ZJMKTRXTZPGRIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-13-4-6-15-10-14(5-7-17(15)20-13)12-19-16-8-9-21-18(2,3)11-16/h4-7,10,16,19H,8-9,11-12H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine?
2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine has a molecular weight of 284.40 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(2-methylquinolin-6-yl)methyl]oxan-4-amine is sourced from PubChem (CID 105378639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).