4-(3,4-diphenylthiophen-2-yl)morpholine

C20H19NOS — CID 2328395

IUPAC4-(3,4-diphenylthiophen-2-yl)morpholine
SMILESc1ccc(-c2csc(N3CCOCC3)c2-c2ccccc2)cc1
InChIInChI=1S/C20H19NOS/c1-3-7-16(8-4-1)18-15-23-20(21-11-13-22-14-12-21)19(18)17-9-5-2-6-10-17/h1-10,15H,11-14H2
InChIKeySOYCNYYCJOQVNP-UHFFFAOYSA-N
MW321.44 g/mol
LogP4.92
Rot. Bonds3

About 4-(3,4-diphenylthiophen-2-yl)morpholine

4-(3,4-diphenylthiophen-2-yl)morpholine (PubChem CID 2328395) has the molecular formula C20H19NOS and a molecular weight of 321.44 g/mol. Its IUPAC name is 4-(3,4-diphenylthiophen-2-yl)morpholine.

Molecular Properties

Compound Name4-(3,4-diphenylthiophen-2-yl)morpholine
PubChem CID2328395
Molecular FormulaC20H19NOS
Molecular Weight321.44 g/mol
Exact Mass321.12
IUPAC Name4-(3,4-diphenylthiophen-2-yl)morpholine
SMILESc1ccc(-c2csc(N3CCOCC3)c2-c2ccccc2)cc1
InChIInChI=1S/C20H19NOS/c1-3-7-16(8-4-1)18-15-23-20(21-11-13-22-14-12-21)19(18)17-9-5-2-6-10-17/h1-10,15H,11-14H2
InChIKeySOYCNYYCJOQVNP-UHFFFAOYSA-N
XLogP4.92
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.44
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3,4-diphenylthiophen-2-yl)morpholine?
The IUPAC name of 4-(3,4-diphenylthiophen-2-yl)morpholine (CID 2328395) is 4-(3,4-diphenylthiophen-2-yl)morpholine.
What is the SMILES notation for 4-(3,4-diphenylthiophen-2-yl)morpholine?
The canonical SMILES for 4-(3,4-diphenylthiophen-2-yl)morpholine is c1ccc(-c2csc(N3CCOCC3)c2-c2ccccc2)cc1.
What is the InChIKey of 4-(3,4-diphenylthiophen-2-yl)morpholine?
The InChIKey is SOYCNYYCJOQVNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NOS/c1-3-7-16(8-4-1)18-15-23-20(21-11-13-22-14-12-21)19(18)17-9-5-2-6-10-17/h1-10,15H,11-14H2.
What are the key properties of 4-(3,4-diphenylthiophen-2-yl)morpholine?
4-(3,4-diphenylthiophen-2-yl)morpholine has a molecular weight of 321.44 g/mol, XLogP of 4.92, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-diphenylthiophen-2-yl)morpholine is sourced from PubChem (CID 2328395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).