4-[(1S,2R)-2-phenoxycyclohexyl]morpholine

C16H23NO2 — CID 92857072

IUPAC4-[(1S,2R)-2-phenoxycyclohexyl]morpholine
SMILESc1ccc(O[C@@H]2CCCC[C@@H]2N2CCOCC2)cc1
InChIInChI=1S/C16H23NO2/c1-2-6-14(7-3-1)19-16-9-5-4-8-15(16)17-10-12-18-13-11-17/h1-3,6-7,15-16H,4-5,8-13H2/t15-,16+/m0/s1
InChIKeyDVPJJTVPVSGTRA-JKSUJKDBSA-N
MW261.36 g/mol
LogP2.71
Rot. Bonds3

About 4-[(1S,2R)-2-phenoxycyclohexyl]morpholine

4-[(1S,2R)-2-phenoxycyclohexyl]morpholine (PubChem CID 92857072) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is 4-[(1S,2R)-2-phenoxycyclohexyl]morpholine.

Molecular Properties

Compound Name4-[(1S,2R)-2-phenoxycyclohexyl]morpholine
PubChem CID92857072
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC Name4-[(1S,2R)-2-phenoxycyclohexyl]morpholine
SMILESc1ccc(O[C@@H]2CCCC[C@@H]2N2CCOCC2)cc1
InChIInChI=1S/C16H23NO2/c1-2-6-14(7-3-1)19-16-9-5-4-8-15(16)17-10-12-18-13-11-17/h1-3,6-7,15-16H,4-5,8-13H2/t15-,16+/m0/s1
InChIKeyDVPJJTVPVSGTRA-JKSUJKDBSA-N
XLogP2.71
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(1S,2R)-2-phenoxycyclohexyl]morpholine?
The IUPAC name of 4-[(1S,2R)-2-phenoxycyclohexyl]morpholine (CID 92857072) is 4-[(1S,2R)-2-phenoxycyclohexyl]morpholine.
What is the SMILES notation for 4-[(1S,2R)-2-phenoxycyclohexyl]morpholine?
The canonical SMILES for 4-[(1S,2R)-2-phenoxycyclohexyl]morpholine is c1ccc(O[C@@H]2CCCC[C@@H]2N2CCOCC2)cc1.
What is the InChIKey of 4-[(1S,2R)-2-phenoxycyclohexyl]morpholine?
The InChIKey is DVPJJTVPVSGTRA-JKSUJKDBSA-N. The full InChI is InChI=1S/C16H23NO2/c1-2-6-14(7-3-1)19-16-9-5-4-8-15(16)17-10-12-18-13-11-17/h1-3,6-7,15-16H,4-5,8-13H2/t15-,16+/m0/s1.
What are the key properties of 4-[(1S,2R)-2-phenoxycyclohexyl]morpholine?
4-[(1S,2R)-2-phenoxycyclohexyl]morpholine has a molecular weight of 261.36 g/mol, XLogP of 2.71, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1S,2R)-2-phenoxycyclohexyl]morpholine is sourced from PubChem (CID 92857072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).