5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol

C17H27NO3 — CID 82958474

IUPAC5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESCOCCN(C(C)COC)C1CCCc2c(O)cccc21
InChIInChI=1S/C17H27NO3/c1-13(12-21-3)18(10-11-20-2)16-8-4-7-15-14(16)6-5-9-17(15)19/h5-6,9,13,16,19H,4,7-8,10-12H2,1-3H3
InChIKeyKVZBNDJOWKUJLB-UHFFFAOYSA-N
MW293.41 g/mol
LogP2.75
Rot. Bonds7

About 5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol

5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol (PubChem CID 82958474) has the molecular formula C17H27NO3 and a molecular weight of 293.41 g/mol. Its IUPAC name is 5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
PubChem CID82958474
Molecular FormulaC17H27NO3
Molecular Weight293.41 g/mol
Exact Mass293.20
IUPAC Name5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESCOCCN(C(C)COC)C1CCCc2c(O)cccc21
InChIInChI=1S/C17H27NO3/c1-13(12-21-3)18(10-11-20-2)16-8-4-7-15-14(16)6-5-9-17(15)19/h5-6,9,13,16,19H,4,7-8,10-12H2,1-3H3
InChIKeyKVZBNDJOWKUJLB-UHFFFAOYSA-N
XLogP2.75
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-methoxyethyl(pentan-3-yl)amino]-2,3-dihydro-1H-inden-4-ol
CID 82986564
5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 82982832
5-[1-(dimethylamino)propan-2-yl-ethylamino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 103192654
5-[butan-2-yl(2-methoxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 82985858
1-[ethyl(propan-2-yl)amino]-2,3-dihydro-1H-inden-4-ol
CID 82976934
5-[3,3-dimethylbutan-2-yl(methyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 82982360
2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide
CID 82978326
1-[(1-methoxy-3-methylbutan-2-yl)amino]-2,3-dihydro-1H-inden-4-ol
CID 65047922
5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 82961944
1-N-(2-methoxyethyl)-1-N-propan-2-yl-2,3-dihydro-1H-indene-1,5-diamine
CID 82965925
1-[cyclopentyl(2-methylpropyl)amino]-2,3-dihydro-1H-inden-4-ol
CID 82982761
1-(dimethylamino)-2,3-dihydro-1H-inden-4-ol
CID 11789767

Frequently Asked Questions

What is the IUPAC name of 5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol?
The IUPAC name of 5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol (CID 82958474) is 5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol?
The canonical SMILES for 5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol is COCCN(C(C)COC)C1CCCc2c(O)cccc21.
What is the InChIKey of 5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol?
The InChIKey is KVZBNDJOWKUJLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO3/c1-13(12-21-3)18(10-11-20-2)16-8-4-7-15-14(16)6-5-9-17(15)19/h5-6,9,13,16,19H,4,7-8,10-12H2,1-3H3.
What are the key properties of 5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol?
5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol has a molecular weight of 293.41 g/mol, XLogP of 2.75, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 82958474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).