1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine

C24H33NO2 — CID 141348697

IUPAC1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine
SMILESCOCC1CCC(Oc2ccc3cc(CN4CCCCC4)ccc3c2)CC1
InChIInChI=1S/C24H33NO2/c1-26-18-19-6-10-23(11-7-19)27-24-12-9-21-15-20(5-8-22(21)16-24)17-25-13-3-2-4-14-25/h5,8-9,12,15-16,19,23H,2-4,6-7,10-11,13-14,17-18H2,1H3
InChIKeyCICLMCSNJUYJFX-UHFFFAOYSA-N
MW367.53 g/mol
LogP5.41
Rot. Bonds6

About 1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine

1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine (PubChem CID 141348697) has the molecular formula C24H33NO2 and a molecular weight of 367.53 g/mol. Its IUPAC name is 1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine.

Molecular Properties

Compound Name1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine
PubChem CID141348697
Molecular FormulaC24H33NO2
Molecular Weight367.53 g/mol
Exact Mass367.25
IUPAC Name1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine
SMILESCOCC1CCC(Oc2ccc3cc(CN4CCCCC4)ccc3c2)CC1
InChIInChI=1S/C24H33NO2/c1-26-18-19-6-10-23(11-7-19)27-24-12-9-21-15-20(5-8-22(21)16-24)17-25-13-3-2-4-14-25/h5,8-9,12,15-16,19,23H,2-4,6-7,10-11,13-14,17-18H2,1H3
InChIKeyCICLMCSNJUYJFX-UHFFFAOYSA-N
XLogP5.41
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.53
LogP ≤ 55.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[6-(4-ethylcyclohexyl)oxynaphthalen-2-yl]methyl]-4-methylpiperidine
CID 126757457
3-cyclohexyl-1-[[6-(4-ethylcyclohexyl)oxynaphthalen-2-yl]methyl]azetidine
CID 154133558
6-[4-(methoxymethyl)cyclohexyl]oxynaphthalene-2-carbaldehyde
CID 91664543
2-ethyl-1-[[6-[4-(propoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine
CID 159427397
ethyl 1-[[6-(4-methylcyclohexyl)oxynaphthalen-2-yl]methyl]piperidine-4-carboxylate
CID 118347020
ethyl (3R)-1-[[6-(4-tert-butylcyclohexyl)oxynaphthalen-2-yl]methyl]piperidine-3-carboxylate
CID 66926766
1-[[6-(4,4-dimethylcyclohexyl)oxynaphthalen-2-yl]methyl]piperidine-4-carboxylic acid;ethyl 1-[[6-(4,4-dimethylcyclohexyl)oxynaphthalen-2-yl]methyl]piperidine-4-carboxylate
CID 158328113
methyl 1-[[6-[4-(2-methoxypropan-2-yl)cyclohexyl]oxynaphthalen-2-yl]methyl]azetidine-3-carboxylate
CID 66926452
ethyl 1-[[6-[3-[1-[[6-(4-propan-2-ylcyclohexyl)oxynaphthalen-2-yl]methyl]piperidine-4-carbonyl]oxycyclobutyl]oxynaphthalen-2-yl]methyl]piperidine-4-carboxylate
CID 146183463
2-ethoxy-4-[[4-(methoxymethyl)piperidin-1-yl]methyl]phenol
CID 82981139
1-[[6-(4,4-dimethylcyclohexyl)oxynaphthalen-2-yl]methyl]-3-(3-methylperoxycyclohexyl)azetidine
CID 144562450
1-[[6-(4-tert-butylcyclohexyl)oxynaphthalen-2-yl]methyl]pyrrolidine-3-carboxylic acid;methane;methyl 1-[[6-(4-tert-butylcyclohexyl)oxynaphthalen-2-yl]methyl]pyrrolidine-3-carboxylate
CID 159481087

Frequently Asked Questions

What is the IUPAC name of 1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine?
The IUPAC name of 1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine (CID 141348697) is 1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine.
What is the SMILES notation for 1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine?
The canonical SMILES for 1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine is COCC1CCC(Oc2ccc3cc(CN4CCCCC4)ccc3c2)CC1.
What is the InChIKey of 1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine?
The InChIKey is CICLMCSNJUYJFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33NO2/c1-26-18-19-6-10-23(11-7-19)27-24-12-9-21-15-20(5-8-22(21)16-24)17-25-13-3-2-4-14-25/h5,8-9,12,15-16,19,23H,2-4,6-7,10-11,13-14,17-18H2,1H3.
What are the key properties of 1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine?
1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine has a molecular weight of 367.53 g/mol, XLogP of 5.41, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[6-[4-(methoxymethyl)cyclohexyl]oxynaphthalen-2-yl]methyl]piperidine is sourced from PubChem (CID 141348697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).