5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol

C16H25NO2 — CID 82982832

IUPAC5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESCC(C)OCCN(C)C1CCCc2c(O)cccc21
InChIInChI=1S/C16H25NO2/c1-12(2)19-11-10-17(3)15-8-4-7-14-13(15)6-5-9-16(14)18/h5-6,9,12,15,18H,4,7-8,10-11H2,1-3H3
InChIKeyACKZDTHGQPOLPN-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.13
Rot. Bonds5

About 5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol

5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol (PubChem CID 82982832) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
PubChem CID82982832
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
SMILESCC(C)OCCN(C)C1CCCc2c(O)cccc21
InChIInChI=1S/C16H25NO2/c1-12(2)19-11-10-17(3)15-8-4-7-14-13(15)6-5-9-16(14)18/h5-6,9,12,15,18H,4,7-8,10-11H2,1-3H3
InChIKeyACKZDTHGQPOLPN-UHFFFAOYSA-N
XLogP3.13
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 82958474
5-[3,3-dimethylbutan-2-yl(methyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 82982360
5-[1-(dimethylamino)propan-2-yl-ethylamino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 103192654
5-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 82961944
1-N-methyl-1-N-(2-propan-2-yloxyethyl)-2,3-dihydro-1H-indene-1,5-diamine
CID 81063269
1-(dimethylamino)-2,3-dihydro-1H-inden-4-ol
CID 11789767
2-[ethyl-(5-hydroxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]-N,N-dimethylacetamide
CID 82978326
1-[2-methoxyethyl(pentan-3-yl)amino]-2,3-dihydro-1H-inden-4-ol
CID 82986564
1-[ethyl(propan-2-yl)amino]-2,3-dihydro-1H-inden-4-ol
CID 82976934
5-[methyl-(2-methyloxolan-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 82983860
1-[cyclopentyl(2-methylpropyl)amino]-2,3-dihydro-1H-inden-4-ol
CID 82982761
N-methyl-N-(2-propan-2-yloxyethyl)-1,2,3,4-tetrahydroisoquinolin-4-amine
CID 81056408

Frequently Asked Questions

What is the IUPAC name of 5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol?
The IUPAC name of 5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol (CID 82982832) is 5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol?
The canonical SMILES for 5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol is CC(C)OCCN(C)C1CCCc2c(O)cccc21.
What is the InChIKey of 5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol?
The InChIKey is ACKZDTHGQPOLPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-12(2)19-11-10-17(3)15-8-4-7-14-13(15)6-5-9-16(14)18/h5-6,9,12,15,18H,4,7-8,10-11H2,1-3H3.
What are the key properties of 5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol?
5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol has a molecular weight of 263.38 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[methyl(2-propan-2-yloxyethyl)amino]-5,6,7,8-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 82982832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).