1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol

C26H38N2O2 — CID 11418428

IUPAC1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol
SMILESCOc1ccc2cc(C(CN3CCC(N(C)C)CC3)C3(O)CCCCC3)ccc2c1
InChIInChI=1S/C26H38N2O2/c1-27(2)23-11-15-28(16-12-23)19-25(26(29)13-5-4-6-14-26)22-8-7-21-18-24(30-3)10-9-20(21)17-22/h7-10,17-18,23,25,29H,4-6,11-16,19H2,1-3H3
InChIKeyCJZZWMSHMCFIFZ-UHFFFAOYSA-N
MW410.60 g/mol
LogP4.65
Rot. Bonds6

About 1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol

1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol (PubChem CID 11418428) has the molecular formula C26H38N2O2 and a molecular weight of 410.60 g/mol. Its IUPAC name is 1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol
PubChem CID11418428
Molecular FormulaC26H38N2O2
Molecular Weight410.60 g/mol
Exact Mass410.29
IUPAC Name1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol
SMILESCOc1ccc2cc(C(CN3CCC(N(C)C)CC3)C3(O)CCCCC3)ccc2c1
InChIInChI=1S/C26H38N2O2/c1-27(2)23-11-15-28(16-12-23)19-25(26(29)13-5-4-6-14-26)22-8-7-21-18-24(30-3)10-9-20(21)17-22/h7-10,17-18,23,25,29H,4-6,11-16,19H2,1-3H3
InChIKeyCJZZWMSHMCFIFZ-UHFFFAOYSA-N
XLogP4.65
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.60
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol with MolForge

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Related Compounds

1-[1-(3-chlorophenyl)-2-[4-[(6-methoxynaphthalen-2-yl)methyl]piperazin-1-yl]ethyl]cyclohexan-1-ol
CID 11330508
1-[2-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-1-(4-phenylmethoxyphenyl)ethyl]cyclohexan-1-ol
CID 11363941
1-[2-[3-(dimethylamino)pyrrolidin-1-yl]-1-(4-phenylmethoxyphenyl)ethyl]cyclohexan-1-ol
CID 72817720
CID 89258781
CID 89258781
1-(2-morpholin-4-yl-1-naphthalen-2-ylethyl)cyclohexan-1-ol;hydrochloride
CID 68855549
1-[1-(3-chloro-4-methoxyphenyl)-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]cyclohexan-1-ol;dihydrochloride
CID 68853409
bis(1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol);hydrochloride
CID 68818348
1-[2-[3-(dimethylamino)pyrrolidin-1-yl]-1-naphthalen-1-ylethyl]cyclohexan-1-ol
CID 72758154
1-(2-morpholin-4-yl-1-naphthalen-2-ylethyl)cyclobutan-1-ol
CID 59701242
1-[1-(4-methoxyphenyl)-2-[methyl(trideuteriomethyl)amino]ethyl]cyclohexan-1-ol
CID 59838669
1-[2-(4-aminopiperidin-1-yl)-1-[4-(trifluoromethoxy)phenyl]ethyl]cyclobutan-1-ol
CID 11750799
4-[2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenol;1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol;methane
CID 158593799

Frequently Asked Questions

What is the IUPAC name of 1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol?
The IUPAC name of 1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol (CID 11418428) is 1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol?
The canonical SMILES for 1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol is COc1ccc2cc(C(CN3CCC(N(C)C)CC3)C3(O)CCCCC3)ccc2c1.
What is the InChIKey of 1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol?
The InChIKey is CJZZWMSHMCFIFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H38N2O2/c1-27(2)23-11-15-28(16-12-23)19-25(26(29)13-5-4-6-14-26)22-8-7-21-18-24(30-3)10-9-20(21)17-22/h7-10,17-18,23,25,29H,4-6,11-16,19H2,1-3H3.
What are the key properties of 1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol?
1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol has a molecular weight of 410.60 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[4-(dimethylamino)piperidin-1-yl]-1-(6-methoxynaphthalen-2-yl)ethyl]cyclohexan-1-ol is sourced from PubChem (CID 11418428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).