6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine

C12H18N2O — CID 83833453

IUPAC6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine
SMILESCNC1Cc2cc(OC)ccc2N(C)C1
InChIInChI=1S/C12H18N2O/c1-13-10-6-9-7-11(15-3)4-5-12(9)14(2)8-10/h4-5,7,10,13H,6,8H2,1-3H3
InChIKeyCTIODGUJHIWRHE-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.28
Rot. Bonds2

About 6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine

6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine (PubChem CID 83833453) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine.

Molecular Properties

Compound Name6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine
PubChem CID83833453
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine
SMILESCNC1Cc2cc(OC)ccc2N(C)C1
InChIInChI=1S/C12H18N2O/c1-13-10-6-9-7-11(15-3)4-5-12(9)14(2)8-10/h4-5,7,10,13H,6,8H2,1-3H3
InChIKeyCTIODGUJHIWRHE-UHFFFAOYSA-N
XLogP1.28
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

7-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine
CID 83833452
(2R)-5-methoxy-N-methyl-2,3-dihydro-1H-inden-2-amine
CID 86334379
2-(5-methoxy-1-methyl-2,3-dihydroindol-2-yl)-N-methylethanamine
CID 117201446
3-(5-methoxy-1-methyl-2,3-dihydroindol-3-yl)-N-methylpropan-1-amine
CID 117202519
3-(5-methoxy-1-methyl-2,3-dihydroindol-2-yl)-N-methylpropan-1-amine
CID 117201453
5-methoxy-2-methyl-2,3-dihydroindol-1-amine
CID 154110611
6-methoxy-N-methyl-3,4-dihydro-2H-chromen-3-amine;hydrochloride
CID 118703251
1-(4-methoxy-2-methylphenyl)-N-methylpiperidin-4-amine
CID 55129581
8-methoxy-1-methyl-5-phenyl-2,3,5,6-tetrahydro-4,1-benzoxazocine
CID 24865095
1-(2,5-dimethoxyphenyl)-N-methylpiperidin-4-amine
CID 43315071
1-(6-methoxy-1-methyl-3,4-dihydro-2H-quinolin-2-yl)-N-methylmethanamine
CID 84623666
2-[(3R)-5-methoxy-1-methyl-2,3-dihydroindol-3-yl]-N,N-dimethylethanamine
CID 170323800

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine?
The IUPAC name of 6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine (CID 83833453) is 6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine.
What is the SMILES notation for 6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine?
The canonical SMILES for 6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine is CNC1Cc2cc(OC)ccc2N(C)C1.
What is the InChIKey of 6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine?
The InChIKey is CTIODGUJHIWRHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-13-10-6-9-7-11(15-3)4-5-12(9)14(2)8-10/h4-5,7,10,13H,6,8H2,1-3H3.
What are the key properties of 6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine?
6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine has a molecular weight of 206.29 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N,1-dimethyl-3,4-dihydro-2H-quinolin-3-amine is sourced from PubChem (CID 83833453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).