4-(4-benzylphenyl)morpholine

C17H19NO — CID 11514364

IUPAC4-(4-benzylphenyl)morpholine
SMILESc1ccc(Cc2ccc(N3CCOCC3)cc2)cc1
InChIInChI=1S/C17H19NO/c1-2-4-15(5-3-1)14-16-6-8-17(9-7-16)18-10-12-19-13-11-18/h1-9H,10-14H2
InChIKeyMUVUHXCBOSOPBK-UHFFFAOYSA-N
MW253.35 g/mol
LogP3.11
Rot. Bonds3

About 4-(4-benzylphenyl)morpholine

4-(4-benzylphenyl)morpholine (PubChem CID 11514364) has the molecular formula C17H19NO and a molecular weight of 253.35 g/mol. Its IUPAC name is 4-(4-benzylphenyl)morpholine.

Molecular Properties

Compound Name4-(4-benzylphenyl)morpholine
PubChem CID11514364
Molecular FormulaC17H19NO
Molecular Weight253.35 g/mol
Exact Mass253.15
IUPAC Name4-(4-benzylphenyl)morpholine
SMILESc1ccc(Cc2ccc(N3CCOCC3)cc2)cc1
InChIInChI=1S/C17H19NO/c1-2-4-15(5-3-1)14-16-6-8-17(9-7-16)18-10-12-19-13-11-18/h1-9H,10-14H2
InChIKeyMUVUHXCBOSOPBK-UHFFFAOYSA-N
XLogP3.11
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

1-(4-benzylphenyl)piperazine
CID 4738749
4-(4-ethylphenyl)morpholine
CID 20576442
(4-morpholin-4-ylphenyl)methanol
CID 2776456
2-(4-morpholin-4-ylphenyl)-1-phenylethanone
CID 22052973
4-(3-benzyl-4-nitrophenyl)morpholine
CID 58425611
1-(4-benzylphenyl)-4-(2-chloroethyl)piperazine
CID 4741784
4-morpholin-4-yl-N-phenylaniline
CID 159018746
2-(4-morpholin-4-ylphenyl)ethanamine
CID 23009596
4-(4-prop-2-enylphenyl)morpholine
CID 70631563
N-methyl-2-(4-morpholin-4-ylphenyl)ethanamine
CID 82616430
N'-benzyl-N-[2-(4-morpholin-4-ylphenyl)ethyl]oxamide
CID 16891636
4-(4-pyrrolidin-1-ylphenyl)morpholine
CID 67305085

Frequently Asked Questions

What is the IUPAC name of 4-(4-benzylphenyl)morpholine?
The IUPAC name of 4-(4-benzylphenyl)morpholine (CID 11514364) is 4-(4-benzylphenyl)morpholine.
What is the SMILES notation for 4-(4-benzylphenyl)morpholine?
The canonical SMILES for 4-(4-benzylphenyl)morpholine is c1ccc(Cc2ccc(N3CCOCC3)cc2)cc1.
What is the InChIKey of 4-(4-benzylphenyl)morpholine?
The InChIKey is MUVUHXCBOSOPBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO/c1-2-4-15(5-3-1)14-16-6-8-17(9-7-16)18-10-12-19-13-11-18/h1-9H,10-14H2.
What are the key properties of 4-(4-benzylphenyl)morpholine?
4-(4-benzylphenyl)morpholine has a molecular weight of 253.35 g/mol, XLogP of 3.11, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-benzylphenyl)morpholine is sourced from PubChem (CID 11514364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).