N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine

C14H21NO — CID 63822452

IUPACN-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCNC1CC(C)Cc2c(OC)cccc21
InChIInChI=1S/C14H21NO/c1-4-15-13-9-10(2)8-12-11(13)6-5-7-14(12)16-3/h5-7,10,13,15H,4,8-9H2,1-3H3
InChIKeyLHZAACSEGGNYSN-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.93
Rot. Bonds3

About N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine

N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 63822452) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID63822452
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC NameN-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCNC1CC(C)Cc2c(OC)cccc21
InChIInChI=1S/C14H21NO/c1-4-15-13-9-10(2)8-12-11(13)6-5-7-14(12)16-3/h5-7,10,13,15H,4,8-9H2,1-3H3
InChIKeyLHZAACSEGGNYSN-UHFFFAOYSA-N
XLogP2.93
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-4-methoxy-2,3-dihydro-1H-inden-1-amine
CID 61383418
5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 63822286
5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 63820817
(5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 84620615
N-ethyl-9-fluoro-8-methoxy-3-methyl-1,3,4,5-tetrahydro-2-benzothiepin-5-amine
CID 113453993
(2S)-8-methoxy-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 67639312
4-methoxy-2-methyl-2,3-dihydro-1H-inden-1-ol
CID 79726670
6-methoxy-4-methyl-1-(2-methylpropyl)-2,3,4,5-tetrahydro-1H-2-benzazepine
CID 64687610
N-ethyl-8-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 64696643
N-ethyl-3-(2-fluoro-3-methoxyphenyl)cyclopentan-1-amine
CID 82812559
N-ethyl-4-(4-methoxybutoxy)-2,3-dihydro-1H-inden-1-amine
CID 104647071
N-ethyl-7-methoxy-2-propyl-3,4-dihydro-2H-chromen-4-amine
CID 114711038

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine (CID 63822452) is N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine is CCNC1CC(C)Cc2c(OC)cccc21.
What is the InChIKey of N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is LHZAACSEGGNYSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-4-15-13-9-10(2)8-12-11(13)6-5-7-14(12)16-3/h5-7,10,13,15H,4,8-9H2,1-3H3.
What are the key properties of N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine?
N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 219.33 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 63822452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).