1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol

C28H34N2O4 — CID 67972760

IUPAC1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol
SMILESOc1ccc2c(Cc3ccc(OCCN4CCOCC4)cc3)c(N3CCC(O)CC3)ccc2c1
InChIInChI=1S/C28H34N2O4/c31-23-9-11-30(12-10-23)28-8-3-22-20-24(32)4-7-26(22)27(28)19-21-1-5-25(6-2-21)34-18-15-29-13-16-33-17-14-29/h1-8,20,23,31-32H,9-19H2
InChIKeyNPUVNVRHLSSVRO-UHFFFAOYSA-N
MW462.59 g/mol
LogP3.81
Rot. Bonds7

About 1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol

1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol (PubChem CID 67972760) has the molecular formula C28H34N2O4 and a molecular weight of 462.59 g/mol. Its IUPAC name is 1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol.

Molecular Properties

Compound Name1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol
PubChem CID67972760
Molecular FormulaC28H34N2O4
Molecular Weight462.59 g/mol
Exact Mass462.25
IUPAC Name1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol
SMILESOc1ccc2c(Cc3ccc(OCCN4CCOCC4)cc3)c(N3CCC(O)CC3)ccc2c1
InChIInChI=1S/C28H34N2O4/c31-23-9-11-30(12-10-23)28-8-3-22-20-24(32)4-7-26(22)27(28)19-21-1-5-25(6-2-21)34-18-15-29-13-16-33-17-14-29/h1-8,20,23,31-32H,9-19H2
InChIKeyNPUVNVRHLSSVRO-UHFFFAOYSA-N
XLogP3.81
TPSA65.40 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500462.59
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol with MolForge

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Related Compounds

1-[1-[[4-[2-[di(propan-2-yl)amino]ethoxy]phenyl]methyl]naphthalen-2-yl]piperidin-4-ol
CID 67987980
7-hydroxy-4-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]-3-phenylchromen-2-one
CID 10182867
6-(4-hydroxyphenyl)-5-[[4-(4-pyrrolidin-1-ylbutoxy)phenyl]methyl]naphthalen-2-ol
CID 18676010
6-(3-hydroxy-4-methylphenyl)-5-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]naphthalen-2-ol
CID 18182697
1-[[4-[2-(4-methylpiperidin-1-yl)ethoxy]phenyl]methyl]naphthalen-2-ol
CID 54578724
2-(4-hydroxyphenyl)-7-(2-morpholin-4-ylethoxy)chromen-4-one
CID 162359881
1-[2-(4-bromophenoxy)ethyl]piperidin-4-ol
CID 39423005
4-[2-(5-methylnaphthalen-2-yl)oxyethyl]morpholine
CID 142855326
4-[2-(4-piperazin-1-ylphenoxy)ethyl]morpholine
CID 43510321
6-(4-hydroxyphenyl)-5-[[4-(3-piperidin-4-ylpropoxy)phenyl]methyl]naphthalen-2-ol
CID 18675935
(2-cycloheptyl-6-hydroxy-1-benzothiophen-3-yl)-[4-(2-morpholin-4-ylethoxy)phenyl]methanone
CID 19424267
methane;4-[2-(4-methylphenoxy)ethyl]morpholine
CID 162149342

Frequently Asked Questions

What is the IUPAC name of 1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol?
The IUPAC name of 1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol (CID 67972760) is 1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol.
What is the SMILES notation for 1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol?
The canonical SMILES for 1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol is Oc1ccc2c(Cc3ccc(OCCN4CCOCC4)cc3)c(N3CCC(O)CC3)ccc2c1.
What is the InChIKey of 1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol?
The InChIKey is NPUVNVRHLSSVRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H34N2O4/c31-23-9-11-30(12-10-23)28-8-3-22-20-24(32)4-7-26(22)27(28)19-21-1-5-25(6-2-21)34-18-15-29-13-16-33-17-14-29/h1-8,20,23,31-32H,9-19H2.
What are the key properties of 1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol?
1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol has a molecular weight of 462.59 g/mol, XLogP of 3.81, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-hydroxy-1-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]naphthalen-2-yl]piperidin-4-ol is sourced from PubChem (CID 67972760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).