2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol

C17H25NO2 — CID 115420002

IUPAC2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCOC1CCN(C2CC(C)c3ccccc3C2O)CC1
InChIInChI=1S/C17H25NO2/c1-12-11-16(18-9-7-13(20-2)8-10-18)17(19)15-6-4-3-5-14(12)15/h3-6,12-13,16-17,19H,7-11H2,1-2H3
InChIKeyKJMXFQAQKSHULS-UHFFFAOYSA-N
MW275.39 g/mol
LogP2.71
Rot. Bonds2

About 2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol

2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 115420002) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is 2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID115420002
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC Name2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCOC1CCN(C2CC(C)c3ccccc3C2O)CC1
InChIInChI=1S/C17H25NO2/c1-12-11-16(18-9-7-13(20-2)8-10-18)17(19)15-6-4-3-5-14(12)15/h3-6,12-13,16-17,19H,7-11H2,1-2H3
InChIKeyKJMXFQAQKSHULS-UHFFFAOYSA-N
XLogP2.71
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 102966127
2-(4-ethylazepan-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420102
4-methyl-2-(3-methylpiperidin-1-yl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115419975
2-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420107
2-(3,3-diethylpyrrolidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420119
2-(2,2-dimethylmorpholin-4-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420017
2-(3-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 102965641
2-(azocan-1-yl)-N,4-dimethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115418831
(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-ol
CID 640582
(3S,4R)-4-(4-methoxypiperidin-1-yl)oxolan-3-ol
CID 126846681
2-(3,4-dimethoxypyrrolidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 103532529
(3S)-1,3-dimethyl-2,3-dihydro-1H-indene
CID 143951833

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol (CID 115420002) is 2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol is COC1CCN(C2CC(C)c3ccccc3C2O)CC1.
What is the InChIKey of 2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is KJMXFQAQKSHULS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-12-11-16(18-9-7-13(20-2)8-10-18)17(19)15-6-4-3-5-14(12)15/h3-6,12-13,16-17,19H,7-11H2,1-2H3.
What are the key properties of 2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol?
2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 275.39 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 115420002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).