5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol

C17H26N2O — CID 82979899

IUPAC5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
SMILESCN1CCCC(N(C)C2CCCc3cc(O)ccc32)C1
InChIInChI=1S/C17H26N2O/c1-18-10-4-6-14(12-18)19(2)17-7-3-5-13-11-15(20)8-9-16(13)17/h8-9,11,14,17,20H,3-7,10,12H2,1-2H3
InChIKeyUYWVWUATCRDPCI-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.80
Rot. Bonds2

About 5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol

5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol (PubChem CID 82979899) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol.

Molecular Properties

Compound Name5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
PubChem CID82979899
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
SMILESCN1CCCC(N(C)C2CCCc3cc(O)ccc32)C1
InChIInChI=1S/C17H26N2O/c1-18-10-4-6-14(12-18)19(2)17-7-3-5-13-11-15(20)8-9-16(13)17/h8-9,11,14,17,20H,3-7,10,12H2,1-2H3
InChIKeyUYWVWUATCRDPCI-UHFFFAOYSA-N
XLogP2.80
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[methyl(oxan-4-ylmethyl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 82980837
1-[methyl-[(1-methylpyrrolidin-2-yl)methyl]amino]-2,3-dihydro-1H-inden-5-ol
CID 107685114
5-(4-fluoro-N-methylanilino)-5,6,7,8-tetrahydronaphthalen-2-ol
CID 82978550
5-[(dimethylamino)methyl]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 105458041
5-(4-ethylpiperidin-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol
CID 82985819
5-methoxy-5,6,7,8-tetrahydronaphthalen-2-ol
CID 105437541
3-fluoro-4-[1-[methyl-(1-methylpiperidin-3-yl)amino]ethyl]phenol
CID 107721085
1-[4-[(dimethylamino)methyl]piperidin-1-yl]-2,3-dihydro-1H-inden-5-ol
CID 107684985
1-[methyl(oxan-4-ylmethyl)amino]-2,3-dihydro-1H-inden-5-ol
CID 107685082
5-(methoxymethyl)-5,6,7,8-tetrahydronaphthalen-2-ol
CID 105446165
5-[2-methylpropyl(pentan-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol
CID 82965932
5-ethyl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 22998647

Frequently Asked Questions

What is the IUPAC name of 5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol?
The IUPAC name of 5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol (CID 82979899) is 5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol.
What is the SMILES notation for 5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol?
The canonical SMILES for 5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol is CN1CCCC(N(C)C2CCCc3cc(O)ccc32)C1.
What is the InChIKey of 5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol?
The InChIKey is UYWVWUATCRDPCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-18-10-4-6-14(12-18)19(2)17-7-3-5-13-11-15(20)8-9-16(13)17/h8-9,11,14,17,20H,3-7,10,12H2,1-2H3.
What are the key properties of 5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol?
5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol has a molecular weight of 274.41 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[methyl-(1-methylpiperidin-3-yl)amino]-5,6,7,8-tetrahydronaphthalen-2-ol is sourced from PubChem (CID 82979899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).