3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine

C16H22N2O — CID 82576928

IUPAC3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine
SMILESCOc1cc(C)nc2c(C)cc(CC(C)CN)cc12
InChIInChI=1S/C16H22N2O/c1-10(9-17)5-13-6-11(2)16-14(8-13)15(19-4)7-12(3)18-16/h6-8,10H,5,9,17H2,1-4H3
InChIKeyMJRHAJGYEJRKEG-UHFFFAOYSA-N
MW258.36 g/mol
LogP3.00
Rot. Bonds4

About 3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine

3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine (PubChem CID 82576928) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine
PubChem CID82576928
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine
SMILESCOc1cc(C)nc2c(C)cc(CC(C)CN)cc12
InChIInChI=1S/C16H22N2O/c1-10(9-17)5-13-6-11(2)16-14(8-13)15(19-4)7-12(3)18-16/h6-8,10H,5,9,17H2,1-4H3
InChIKeyMJRHAJGYEJRKEG-UHFFFAOYSA-N
XLogP3.00
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-methoxy-3-methylphenyl)-2-methylpropan-1-amine
CID 83818376
3-(2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine
CID 82576782
4-methoxy-2,8-dimethylquinoline-6-carbothioamide
CID 82574299
3-(4-methoxy-2,3,6-trimethylphenyl)-2-methylpropan-1-amine
CID 116924769
1-amino-3-(3,4,5-trimethoxyphenyl)propan-2-ol
CID 112508543
3-(5-chloro-6-methoxy-3-pyridinyl)-2-methylpropan-1-amine
CID 83886505
3-(7-methoxy-4-methylquinolin-2-yl)-2-methylpropan-1-amine
CID 82576819
2-(5,8-dimethoxy-3-methylquinolin-2-yl)propan-1-amine
CID 84638168
3-(5-methoxy-2-methylpyrimidin-4-yl)-2-methylpropan-1-amine
CID 83879523
3-(6-fluoro-4-methoxy-2-methylquinolin-8-yl)-2,2-dimethylpropan-1-amine
CID 82577151
3-(3-bromo-5-fluoro-4-methoxyphenyl)-2-methylpropan-1-amine
CID 83904412
8-fluoro-4-methoxy-2-methylquinoline-6-carbonitrile
CID 82573333

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine?
The IUPAC name of 3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine (CID 82576928) is 3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine.
What is the SMILES notation for 3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine?
The canonical SMILES for 3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine is COc1cc(C)nc2c(C)cc(CC(C)CN)cc12.
What is the InChIKey of 3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine?
The InChIKey is MJRHAJGYEJRKEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-10(9-17)5-13-6-11(2)16-14(8-13)15(19-4)7-12(3)18-16/h6-8,10H,5,9,17H2,1-4H3.
What are the key properties of 3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine?
3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine has a molecular weight of 258.36 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxy-2,8-dimethylquinolin-6-yl)-2-methylpropan-1-amine is sourced from PubChem (CID 82576928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).