4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol

C18H28N2O — CID 115419981

IUPAC4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCC1CC(N(C)C2CCN(C)CC2)C(O)c2ccccc21
InChIInChI=1S/C18H28N2O/c1-13-12-17(18(21)16-7-5-4-6-15(13)16)20(3)14-8-10-19(2)11-9-14/h4-7,13-14,17-18,21H,8-12H2,1-3H3
InChIKeyABJNTTLFGIQSIV-UHFFFAOYSA-N
MW288.43 g/mol
LogP2.62
Rot. Bonds2

About 4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol

4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol (PubChem CID 115419981) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is 4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol
PubChem CID115419981
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC Name4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol
SMILESCC1CC(N(C)C2CCN(C)CC2)C(O)c2ccccc21
InChIInChI=1S/C18H28N2O/c1-13-12-17(18(21)16-7-5-4-6-15(13)16)20(3)14-8-10-19(2)11-9-14/h4-7,13-14,17-18,21H,8-12H2,1-3H3
InChIKeyABJNTTLFGIQSIV-UHFFFAOYSA-N
XLogP2.62
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[ethyl(methyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115419992
4-methyl-2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420047
4-methyl-2-[methyl(pyridin-4-ylmethyl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420013
3-[methyl-(1-methylpiperidin-3-yl)amino]-3,4-dihydro-2H-chromen-4-ol
CID 62545588
6-ethyl-3-[methyl-(1-methylpiperidin-4-yl)amino]-3,4-dihydro-2H-chromen-4-ol
CID 82186664
(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-ol
CID 640582
(3S,4R)-4-[methyl-(1-methylpiperidin-4-yl)amino]oxolan-3-ol
CID 126846654
(3S)-1,3-dimethyl-2,3-dihydro-1H-indene
CID 143951833
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-(4-methoxypiperidin-1-yl)-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420002
4-methyl-2-(3-methylpiperidin-1-yl)-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115419975
2-[ethyl(oxolan-2-ylmethyl)amino]-4-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115420032

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol?
The IUPAC name of 4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol (CID 115419981) is 4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol?
The canonical SMILES for 4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol is CC1CC(N(C)C2CCN(C)CC2)C(O)c2ccccc21.
What is the InChIKey of 4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol?
The InChIKey is ABJNTTLFGIQSIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-13-12-17(18(21)16-7-5-4-6-15(13)16)20(3)14-8-10-19(2)11-9-14/h4-7,13-14,17-18,21H,8-12H2,1-3H3.
What are the key properties of 4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol?
4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol has a molecular weight of 288.43 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[methyl-(1-methylpiperidin-4-yl)amino]-1,2,3,4-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 115419981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).