(1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine

C13H19NO — CID 115417533

IUPAC(1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCOc1ccc2c(c1)[C@H](N)CCC2C
InChIInChI=1S/C13H19NO/c1-3-15-10-5-6-11-9(2)4-7-13(14)12(11)8-10/h5-6,8-9,13H,3-4,7,14H2,1-2H3/t9?,13-/m1/s1
InChIKeyJZNVGPLRAZULBV-WCRCJTMVSA-N
MW205.30 g/mol
LogP2.98
Rot. Bonds2

About (1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine

(1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 115417533) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is (1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name(1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID115417533
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name(1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCOc1ccc2c(c1)[C@H](N)CCC2C
InChIInChI=1S/C13H19NO/c1-3-15-10-5-6-11-9(2)4-7-13(14)12(11)8-10/h5-6,8-9,13H,3-4,7,14H2,1-2H3/t9?,13-/m1/s1
InChIKeyJZNVGPLRAZULBV-WCRCJTMVSA-N
XLogP2.98
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-ethoxy-4-methyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417532
(1S)-5-ethoxy-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 70817218
(1R)-5-bromo-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417759
3-ethoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 62737273
(5S)-3-ethoxy-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 79014278
6-ethoxy-2,3-dimethyl-2,3-dihydro-1H-inden-1-amine
CID 79728842
(1S)-7-fluoro-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417616
7-fluoro-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417620
(1S)-6,7-diethyl-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115483191
(4R)-7-ethoxy-3,4-dihydro-1H-isochromen-4-amine
CID 131221796
4,6-dimethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 155465000
8-bromo-5-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417517

Frequently Asked Questions

What is the IUPAC name of (1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of (1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine (CID 115417533) is (1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for (1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for (1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine is CCOc1ccc2c(c1)[C@H](N)CCC2C.
What is the InChIKey of (1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is JZNVGPLRAZULBV-WCRCJTMVSA-N. The full InChI is InChI=1S/C13H19NO/c1-3-15-10-5-6-11-9(2)4-7-13(14)12(11)8-10/h5-6,8-9,13H,3-4,7,14H2,1-2H3/t9?,13-/m1/s1.
What are the key properties of (1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
(1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 205.30 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-7-ethoxy-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 115417533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).