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

C13H19NO — CID 84620622

IUPAC6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine
SMILESCOc1ccc2c(c1)CC(C)(C)CC2N
InChIInChI=1S/C13H19NO/c1-13(2)7-9-6-10(15-3)4-5-11(9)12(14)8-13/h4-6,12H,7-8,14H2,1-3H3
InChIKeyJFQMOTXBWVYBSF-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.67
Rot. Bonds1

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

6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine (PubChem CID 84620622) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine.

Molecular Properties

Compound Name6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine
PubChem CID84620622
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine
SMILESCOc1ccc2c(c1)CC(C)(C)CC2N
InChIInChI=1S/C13H19NO/c1-13(2)7-9-6-10(15-3)4-5-11(9)12(14)8-13/h4-6,12H,7-8,14H2,1-3H3
InChIKeyJFQMOTXBWVYBSF-UHFFFAOYSA-N
XLogP2.67
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,5-dimethoxy-2,2-dimethyl-1,3-dihydroindene
CID 10398076
(1R,2R)-2-(hydroxymethyl)-5-methoxy-2-methyl-1,3-dihydroinden-1-ol
CID 56945780
(6-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 84620620
(4R)-4-amino-6-methoxy-2,2-dimethyl-3,4-dihydronaphthalen-1-one
CID 124562773
2-(2,2-dimethylcyclopropyl)-5-methoxyaniline
CID 121014201
8-methoxy-1,3,4,5-tetrahydro-2-benzoxepin-5-amine
CID 170899412
5-methoxy-2-methyl-1,3-dihydroinden-2-amine
CID 84717968
(4S)-7-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-amine
CID 96653094
(4R)-2-heptyl-7-methoxy-2-methyl-3,4-dihydrochromen-4-amine
CID 104944785
(3Z,3aS,9bR)-3-ethylidene-7-methoxy-3a-methyl-2,4,5,9b-tetrahydro-1H-cyclopenta[a]naphthalene
CID 10999207
3',7-dimethoxyspiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-amine
CID 106825079
2-amino-6-methoxy-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-ol
CID 84623934

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine?
The IUPAC name of 6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine (CID 84620622) is 6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine.
What is the SMILES notation for 6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine?
The canonical SMILES for 6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine is COc1ccc2c(c1)CC(C)(C)CC2N.
What is the InChIKey of 6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine?
The InChIKey is JFQMOTXBWVYBSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-13(2)7-9-6-10(15-3)4-5-11(9)12(14)8-13/h4-6,12H,7-8,14H2,1-3H3.
What are the key properties of 6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine?
6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine has a molecular weight of 205.30 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalen-1-amine is sourced from PubChem (CID 84620622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).