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

C14H22N2O — CID 81102110

IUPAC1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine
SMILESCOCC(N)CN1CCCc2cc(C)ccc21
InChIInChI=1S/C14H22N2O/c1-11-5-6-14-12(8-11)4-3-7-16(14)9-13(15)10-17-2/h5-6,8,13H,3-4,7,9-10,15H2,1-2H3
InChIKeyXILQMIBLXFUQTF-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.72
Rot. Bonds4

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

1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine (PubChem CID 81102110) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine.

Molecular Properties

Compound Name1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine
PubChem CID81102110
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine
SMILESCOCC(N)CN1CCCc2cc(C)ccc21
InChIInChI=1S/C14H22N2O/c1-11-5-6-14-12(8-11)4-3-7-16(14)9-13(15)10-17-2/h5-6,8,13H,3-4,7,9-10,15H2,1-2H3
InChIKeyXILQMIBLXFUQTF-UHFFFAOYSA-N
XLogP1.72
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,4-dihydro-2H-quinolin-1-yl)-3-methoxypropan-2-amine
CID 81101379
1-amino-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-ol
CID 24698210
1-ethoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-ol
CID 63934170
6-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)hexan-3-amine
CID 106799282
2-methyl-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanoic acid
CID 43538734
ethane;1-ethyl-6-methyl-3,4-dihydro-2H-quinoline
CID 143643901
N-methyl-1-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-2-amine
CID 62041176
1-(3,4-dihydro-2H-quinolin-1-yl)-4-methoxybutan-2-amine
CID 62476969
3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propanamide
CID 60698848
3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)-2-(propylamino)propan-1-ol
CID 64796022
N-[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)ethyl]propan-2-amine
CID 60841491
1-[4-[2-hydroxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propoxy]-3-methoxyphenyl]ethanone
CID 51271270

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine?
The IUPAC name of 1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine (CID 81102110) is 1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine.
What is the SMILES notation for 1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine?
The canonical SMILES for 1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine is COCC(N)CN1CCCc2cc(C)ccc21.
What is the InChIKey of 1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine?
The InChIKey is XILQMIBLXFUQTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-11-5-6-14-12(8-11)4-3-7-16(14)9-13(15)10-17-2/h5-6,8,13H,3-4,7,9-10,15H2,1-2H3.
What are the key properties of 1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine?
1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine has a molecular weight of 234.34 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-3-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-2-amine is sourced from PubChem (CID 81102110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).