4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine

C21H35N3O2 — CID 56893078

IUPAC4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine
SMILESc1c(C2CCCCC2)noc1CN1CCCCC1CCN1CCOCC1
InChIInChI=1S/C21H35N3O2/c1-2-6-18(7-3-1)21-16-20(26-22-21)17-24-10-5-4-8-19(24)9-11-23-12-14-25-15-13-23/h16,18-19H,1-15,17H2
InChIKeyREKKAECUARAAPH-UHFFFAOYSA-N
MW361.53 g/mol
LogP3.80
Rot. Bonds6

About 4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine

4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine (PubChem CID 56893078) has the molecular formula C21H35N3O2 and a molecular weight of 361.53 g/mol. Its IUPAC name is 4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine
PubChem CID56893078
Molecular FormulaC21H35N3O2
Molecular Weight361.53 g/mol
Exact Mass361.27
IUPAC Name4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine
SMILESc1c(C2CCCCC2)noc1CN1CCCCC1CCN1CCOCC1
InChIInChI=1S/C21H35N3O2/c1-2-6-18(7-3-1)21-16-20(26-22-21)17-24-10-5-4-8-19(24)9-11-23-12-14-25-15-13-23/h16,18-19H,1-15,17H2
InChIKeyREKKAECUARAAPH-UHFFFAOYSA-N
XLogP3.80
TPSA41.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.53
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-[(2S)-1-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-2-yl]ethyl]morpholine
CID 95718058
4-[2-[1-[(5-fluoro-2-methylphenyl)methyl]piperidin-2-yl]ethyl]morpholine
CID 56895170
4-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]-1-methyl-9-oxa-1,4-diazaspiro[5.5]undecane;formic acid
CID 154919996
4-[2-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidin-2-yl]ethyl]morpholine
CID 56904273
2-[[(2R)-2-(2-morpholin-4-ylethyl)piperidin-1-yl]methyl]pyridine-3-carboxylic acid
CID 95132226
5-[(2-propylpiperidin-1-yl)methyl]-1,2-oxazole-3-carboxylic acid
CID 83056535
[(4aS,6R)-4-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-6-yl]methanol
CID 154567630
4-[2-[1-[[3-(difluoromethoxy)phenyl]methyl]piperidin-2-yl]ethyl]morpholine
CID 70726930
4-[2-[(2S)-1-[[5-(3-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]piperidin-2-yl]ethyl]morpholine
CID 95720641
3-[1-[(3-methyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]propanoic acid
CID 62216991
5-[(2-ethylpiperidin-1-yl)methyl]-1,2-oxazole-3-carboxylic acid
CID 61397898
(3S)-4-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]-3-methyl-1-(2-methylpropyl)piperazin-2-one
CID 95710005

Frequently Asked Questions

What is the IUPAC name of 4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine?
The IUPAC name of 4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine (CID 56893078) is 4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine.
What is the SMILES notation for 4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine?
The canonical SMILES for 4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine is c1c(C2CCCCC2)noc1CN1CCCCC1CCN1CCOCC1.
What is the InChIKey of 4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine?
The InChIKey is REKKAECUARAAPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H35N3O2/c1-2-6-18(7-3-1)21-16-20(26-22-21)17-24-10-5-4-8-19(24)9-11-23-12-14-25-15-13-23/h16,18-19H,1-15,17H2.
What are the key properties of 4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine?
4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine has a molecular weight of 361.53 g/mol, XLogP of 3.80, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[1-[(3-cyclohexyl-1,2-oxazol-5-yl)methyl]piperidin-2-yl]ethyl]morpholine is sourced from PubChem (CID 56893078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).