3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine

C15H20N2O2 — CID 82576667

IUPAC3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine
SMILESCOc1cc2nc(C)cc(CCCN)c2cc1OC
InChIInChI=1S/C15H20N2O2/c1-10-7-11(5-4-6-16)12-8-14(18-2)15(19-3)9-13(12)17-10/h7-9H,4-6,16H2,1-3H3
InChIKeyMTMQAXOAYSJVJS-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.45
Rot. Bonds5

About 3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine

3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine (PubChem CID 82576667) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine.

Molecular Properties

Compound Name3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine
PubChem CID82576667
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine
SMILESCOc1cc2nc(C)cc(CCCN)c2cc1OC
InChIInChI=1S/C15H20N2O2/c1-10-7-11(5-4-6-16)12-8-14(18-2)15(19-3)9-13(12)17-10/h7-9H,4-6,16H2,1-3H3
InChIKeyMTMQAXOAYSJVJS-UHFFFAOYSA-N
XLogP2.45
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6,7-dimethoxy-2-methylquinolin-4-amine;hydrochloride
CID 91665053
3-[10-(3-aminopropyl)-2,3,6,7-tetramethoxyanthracen-9-yl]propan-1-amine;dihydrochloride
CID 10390646
4-(2,6-dimethylquinolin-4-yl)butan-1-amine
CID 82577777
2,3,6,7-tetramethoxy-9-methylacridine
CID 46187785
4-chloro-6,7-dimethoxy-2-methylquinoline
CID 39732475
4-(6-ethyl-2-methylquinolin-4-yl)butan-1-amine
CID 82577783
4-[2-methyl-6-[(2-methylpropan-2-yl)oxy]quinolin-4-yl]butan-1-amine
CID 82577822
3-(2,8-dimethylquinolin-4-yl)propan-1-amine
CID 82576634
3-[1-(3-aminopropyl)-5,6-dimethoxyindol-3-yl]propan-1-amine
CID 83948403
3-[2-(1-fluoroethyl)-4,5-dimethoxyphenyl]propan-1-amine
CID 117355470
6,7-dimethoxy-2,4-dimethylquinazoline;ethane
CID 163274874
2-(6,7-dimethoxy-2-methylquinolin-4-yl)oxyacetic acid
CID 53264216

Frequently Asked Questions

What is the IUPAC name of 3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine?
The IUPAC name of 3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine (CID 82576667) is 3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine.
What is the SMILES notation for 3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine?
The canonical SMILES for 3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine is COc1cc2nc(C)cc(CCCN)c2cc1OC.
What is the InChIKey of 3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine?
The InChIKey is MTMQAXOAYSJVJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-10-7-11(5-4-6-16)12-8-14(18-2)15(19-3)9-13(12)17-10/h7-9H,4-6,16H2,1-3H3.
What are the key properties of 3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine?
3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine has a molecular weight of 260.34 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6,7-dimethoxy-2-methylquinolin-4-yl)propan-1-amine is sourced from PubChem (CID 82576667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).