(5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone

C19H15ClFNO3 — CID 134044267

IUPAC(5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone
SMILESO=C(c1cc2cc(Cl)ccc2o1)N1CCOC(c2ccc(F)cc2)C1
InChIInChI=1S/C19H15ClFNO3/c20-14-3-6-16-13(9-14)10-17(25-16)19(23)22-7-8-24-18(11-22)12-1-4-15(21)5-2-12/h1-6,9-10,18H,7-8,11H2
InChIKeyDPRHOYHWRBGHDN-UHFFFAOYSA-N
MW359.78 g/mol
LogP4.44
Rot. Bonds2

About (5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone

(5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone (PubChem CID 134044267) has the molecular formula C19H15ClFNO3 and a molecular weight of 359.78 g/mol. Its IUPAC name is (5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone.

Molecular Properties

Compound Name(5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone
PubChem CID134044267
Molecular FormulaC19H15ClFNO3
Molecular Weight359.78 g/mol
Exact Mass359.07
IUPAC Name(5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone
SMILESO=C(c1cc2cc(Cl)ccc2o1)N1CCOC(c2ccc(F)cc2)C1
InChIInChI=1S/C19H15ClFNO3/c20-14-3-6-16-13(9-14)10-17(25-16)19(23)22-7-8-24-18(11-22)12-1-4-15(21)5-2-12/h1-6,9-10,18H,7-8,11H2
InChIKeyDPRHOYHWRBGHDN-UHFFFAOYSA-N
XLogP4.44
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.78
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone?
The IUPAC name of (5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone (CID 134044267) is (5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone.
What is the SMILES notation for (5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone?
The canonical SMILES for (5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone is O=C(c1cc2cc(Cl)ccc2o1)N1CCOC(c2ccc(F)cc2)C1.
What is the InChIKey of (5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone?
The InChIKey is DPRHOYHWRBGHDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClFNO3/c20-14-3-6-16-13(9-14)10-17(25-16)19(23)22-7-8-24-18(11-22)12-1-4-15(21)5-2-12/h1-6,9-10,18H,7-8,11H2.
What are the key properties of (5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone?
(5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone has a molecular weight of 359.78 g/mol, XLogP of 4.44, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-1-benzofuran-2-yl)-[2-(4-fluorophenyl)morpholin-4-yl]methanone is sourced from PubChem (CID 134044267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).