2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine

C18H28N2O — CID 104958357

IUPAC2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCNC1c2ccccc2CCC1N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C18H28N2O/c1-4-19-18-16-8-6-5-7-15(16)9-10-17(18)20-11-13(2)21-14(3)12-20/h5-8,13-14,17-19H,4,9-12H2,1-3H3/t13-,14+,17?,18?
InChIKeyIVHSHQVEVSYNFM-MWABVPJASA-N
MW288.44 g/mol
LogP2.76
Rot. Bonds3

About 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine

2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 104958357) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID104958357
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC Name2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCNC1c2ccccc2CCC1N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C18H28N2O/c1-4-19-18-16-8-6-5-7-15(16)9-10-17(18)20-11-13(2)21-14(3)12-20/h5-8,13-14,17-19H,4,9-12H2,1-3H3/t13-,14+,17?,18?
InChIKeyIVHSHQVEVSYNFM-MWABVPJASA-N
XLogP2.76
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine with MolForge

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Related Compounds

N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine
CID 66391699
N-ethyl-2-methylsulfanyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64626278
N-ethyl-2-ethylsulfonyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64646782
N-ethyl-2-methylsulfinyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64656023
2-(2-methyl-1,4-oxazepan-4-yl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 62972576
2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-2,3-dihydro-1H-inden-1-amine
CID 62331020
2-(3-methoxypyrrolidin-1-yl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 103532366
N-ethyl-4-methyl-2-(3-methylpyrrolidin-1-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115418929
N-ethyl-2-(2-propylpiperidin-1-yl)-2,3-dihydro-1H-inden-1-amine
CID 83053543
3-[[1-(ethylamino)-1,2,3,4-tetrahydronaphthalen-2-yl]sulfanyl]butan-1-ol
CID 66136675
N-ethyl-2-(2-thiophen-2-ylethyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 63773845
N-ethyl-2-(3-methoxy-3-methylbutoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 106665345

Frequently Asked Questions

What is the IUPAC name of 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine (CID 104958357) is 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine is CCNC1c2ccccc2CCC1N1C[C@@H](C)O[C@@H](C)C1.
What is the InChIKey of 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is IVHSHQVEVSYNFM-MWABVPJASA-N. The full InChI is InChI=1S/C18H28N2O/c1-4-19-18-16-8-6-5-7-15(16)9-10-17(18)20-11-13(2)21-14(3)12-20/h5-8,13-14,17-19H,4,9-12H2,1-3H3/t13-,14+,17?,18?.
What are the key properties of 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine?
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 288.44 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 104958357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).