6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine

C18H29NO2 — CID 103283356

IUPAC6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCCC(C)COC1CCc2cc(OC)ccc2C1NC
InChIInChI=1S/C18H29NO2/c1-5-6-13(2)12-21-17-10-7-14-11-15(20-4)8-9-16(14)18(17)19-3/h8-9,11,13,17-19H,5-7,10,12H2,1-4H3
InChIKeyRGBPHSYERYKJSC-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.72
Rot. Bonds7

About 6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine

6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine (PubChem CID 103283356) has the molecular formula C18H29NO2 and a molecular weight of 291.44 g/mol. Its IUPAC name is 6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound Name6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
PubChem CID103283356
Molecular FormulaC18H29NO2
Molecular Weight291.44 g/mol
Exact Mass291.22
IUPAC Name6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
SMILESCCCC(C)COC1CCc2cc(OC)ccc2C1NC
InChIInChI=1S/C18H29NO2/c1-5-6-13(2)12-21-17-10-7-14-11-15(20-4)8-9-16(14)18(17)19-3/h8-9,11,13,17-19H,5-7,10,12H2,1-4H3
InChIKeyRGBPHSYERYKJSC-UHFFFAOYSA-N
XLogP3.72
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,2-difluoroethoxy)-6-methoxy-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 82006055
7-methoxy-N-methyl-2-(3,3,3-trifluoropropoxy)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 82960676
2-(2,2-difluoroethoxy)-N-ethyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 82003829
N-methyl-5-(2-methylpropoxy)-2,3-dihydro-1H-inden-1-amine
CID 107683424
6-methoxy-1-N,2-N-dimethyl-2-N-pentan-2-yl-2,3-dihydro-1H-indene-1,2-diamine
CID 79376099
1-(6,13-dimethoxy-2-tricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaenyl)-N-ethylpropan-2-amine
CID 83985301
6-methoxy-N-(5-methylhexyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115324453
[6-methoxy-1-(propylamino)-1,2,3,4-tetrahydronaphthalen-2-yl]methanol
CID 64814688
N-methyl-6-pentan-2-yloxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 114013297
N-ethyl-6-methoxy-2-(3-methylbutan-2-ylsulfanyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 107763324
3-[[6-methoxy-1-(methylamino)-1,2,3,4-tetrahydronaphthalen-2-yl]sulfanyl]propan-1-ol
CID 66127727
N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43190307

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine?
The IUPAC name of 6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine (CID 103283356) is 6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine.
What is the SMILES notation for 6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine?
The canonical SMILES for 6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine is CCCC(C)COC1CCc2cc(OC)ccc2C1NC.
What is the InChIKey of 6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine?
The InChIKey is RGBPHSYERYKJSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO2/c1-5-6-13(2)12-21-17-10-7-14-11-15(20-4)8-9-16(14)18(17)19-3/h8-9,11,13,17-19H,5-7,10,12H2,1-4H3.
What are the key properties of 6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine?
6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine has a molecular weight of 291.44 g/mol, XLogP of 3.72, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-methyl-2-(2-methylpentoxy)-1,2,3,4-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 103283356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).