(5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone

C18H15ClN2O3 — CID 58707364

IUPAC(5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone
SMILESO=C(c1cc2cc(Cl)ccc2o1)c1cnccc1N1CCOCC1
InChIInChI=1S/C18H15ClN2O3/c19-13-1-2-16-12(9-13)10-17(24-16)18(22)14-11-20-4-3-15(14)21-5-7-23-8-6-21/h1-4,9-11H,5-8H2
InChIKeyQMADVKXQINKKAT-UHFFFAOYSA-N
MW342.78 g/mol
LogP3.55
Rot. Bonds3

About (5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone

(5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone (PubChem CID 58707364) has the molecular formula C18H15ClN2O3 and a molecular weight of 342.78 g/mol. Its IUPAC name is (5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone.

Molecular Properties

Compound Name(5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone
PubChem CID58707364
Molecular FormulaC18H15ClN2O3
Molecular Weight342.78 g/mol
Exact Mass342.08
IUPAC Name(5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone
SMILESO=C(c1cc2cc(Cl)ccc2o1)c1cnccc1N1CCOCC1
InChIInChI=1S/C18H15ClN2O3/c19-13-1-2-16-12(9-13)10-17(24-16)18(22)14-11-20-4-3-15(14)21-5-7-23-8-6-21/h1-4,9-11H,5-8H2
InChIKeyQMADVKXQINKKAT-UHFFFAOYSA-N
XLogP3.55
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.78
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone with MolForge

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Related Compounds

(5-chloro-1-benzofuran-2-yl)-pyrazolo[1,5-a]pyrazin-3-ylmethanone
CID 103125431
1-(4-morpholin-4-yl-3-pyridinyl)ethanone
CID 83882794
(5-chloro-1-benzofuran-2-yl)-(5-chloro-2-fluorophenyl)methanone
CID 114885265
(5-chloro-1-benzofuran-2-yl)-(2-pyridin-4-ylazepan-1-yl)methanone
CID 55764469
(5-chloro-1-benzofuran-2-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 103125429
5-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)-1-benzofuran-2-carboxamide
CID 51219508
2-amino-1-(5-chloro-2-morpholin-4-ylphenyl)ethanone
CID 117390088
(5-chloro-1-benzofuran-2-yl)-(2-methyl-4-pyridinyl)methanone
CID 106754789
3-(5-chloro-1-benzofuran-2-yl)pyridine-4-carboxylic acid
CID 114731678
(5-chloro-1-benzofuran-2-yl)-(1,2,5-trimethylpyrrol-3-yl)methanone
CID 25481768
(5-chloro-1-benzofuran-2-yl)-(2-methylfuran-3-yl)methanone
CID 114726089
(5-chloro-1-benzofuran-2-yl)-(3-methylmorpholin-4-yl)methanone
CID 56811977

Frequently Asked Questions

What is the IUPAC name of (5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone?
The IUPAC name of (5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone (CID 58707364) is (5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone.
What is the SMILES notation for (5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone?
The canonical SMILES for (5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone is O=C(c1cc2cc(Cl)ccc2o1)c1cnccc1N1CCOCC1.
What is the InChIKey of (5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone?
The InChIKey is QMADVKXQINKKAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O3/c19-13-1-2-16-12(9-13)10-17(24-16)18(22)14-11-20-4-3-15(14)21-5-7-23-8-6-21/h1-4,9-11H,5-8H2.
What are the key properties of (5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone?
(5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone has a molecular weight of 342.78 g/mol, XLogP of 3.55, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-1-benzofuran-2-yl)-(4-morpholin-4-yl-3-pyridinyl)methanone is sourced from PubChem (CID 58707364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).