4-[(1-phenylcyclohexyl)methyl]morpholine

C17H25NO — CID 567602

IUPAC4-[(1-phenylcyclohexyl)methyl]morpholine
SMILESc1ccc(C2(CN3CCOCC3)CCCCC2)cc1
InChIInChI=1S/C17H25NO/c1-3-7-16(8-4-1)17(9-5-2-6-10-17)15-18-11-13-19-14-12-18/h1,3-4,7-8H,2,5-6,9-15H2
InChIKeyVXGCBRQAAYLTLQ-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.22
Rot. Bonds3

About 4-[(1-phenylcyclohexyl)methyl]morpholine

4-[(1-phenylcyclohexyl)methyl]morpholine (PubChem CID 567602) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 4-[(1-phenylcyclohexyl)methyl]morpholine.

Molecular Properties

Compound Name4-[(1-phenylcyclohexyl)methyl]morpholine
PubChem CID567602
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name4-[(1-phenylcyclohexyl)methyl]morpholine
SMILESc1ccc(C2(CN3CCOCC3)CCCCC2)cc1
InChIInChI=1S/C17H25NO/c1-3-7-16(8-4-1)17(9-5-2-6-10-17)15-18-11-13-19-14-12-18/h1,3-4,7-8H,2,5-6,9-15H2
InChIKeyVXGCBRQAAYLTLQ-UHFFFAOYSA-N
XLogP3.22
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(1-phenylcyclohexyl)methyl]morpholine?
The IUPAC name of 4-[(1-phenylcyclohexyl)methyl]morpholine (CID 567602) is 4-[(1-phenylcyclohexyl)methyl]morpholine.
What is the SMILES notation for 4-[(1-phenylcyclohexyl)methyl]morpholine?
The canonical SMILES for 4-[(1-phenylcyclohexyl)methyl]morpholine is c1ccc(C2(CN3CCOCC3)CCCCC2)cc1.
What is the InChIKey of 4-[(1-phenylcyclohexyl)methyl]morpholine?
The InChIKey is VXGCBRQAAYLTLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-3-7-16(8-4-1)17(9-5-2-6-10-17)15-18-11-13-19-14-12-18/h1,3-4,7-8H,2,5-6,9-15H2.
What are the key properties of 4-[(1-phenylcyclohexyl)methyl]morpholine?
4-[(1-phenylcyclohexyl)methyl]morpholine has a molecular weight of 259.39 g/mol, XLogP of 3.22, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-phenylcyclohexyl)methyl]morpholine is sourced from PubChem (CID 567602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).