4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one

C15H15ClN2O2 — CID 171499292

IUPAC4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one
SMILESO=c1cc(-c2cc(Cl)cc(C3COCCN3)c2)cc[nH]1
InChIInChI=1S/C15H15ClN2O2/c16-13-6-11(10-1-2-18-15(19)8-10)5-12(7-13)14-9-20-4-3-17-14/h1-2,5-8,14,17H,3-4,9H2,(H,18,19)
InChIKeyZADHATBBHBOVKQ-UHFFFAOYSA-N
MW290.75 g/mol
LogP2.36
Rot. Bonds2

About 4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one

4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one (PubChem CID 171499292) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one
PubChem CID171499292
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one
SMILESO=c1cc(-c2cc(Cl)cc(C3COCCN3)c2)cc[nH]1
InChIInChI=1S/C15H15ClN2O2/c16-13-6-11(10-1-2-18-15(19)8-10)5-12(7-13)14-9-20-4-3-17-14/h1-2,5-8,14,17H,3-4,9H2,(H,18,19)
InChIKeyZADHATBBHBOVKQ-UHFFFAOYSA-N
XLogP2.36
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one?
The IUPAC name of 4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one (CID 171499292) is 4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one.
What is the SMILES notation for 4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one?
The canonical SMILES for 4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one is O=c1cc(-c2cc(Cl)cc(C3COCCN3)c2)cc[nH]1.
What is the InChIKey of 4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one?
The InChIKey is ZADHATBBHBOVKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c16-13-6-11(10-1-2-18-15(19)8-10)5-12(7-13)14-9-20-4-3-17-14/h1-2,5-8,14,17H,3-4,9H2,(H,18,19).
What are the key properties of 4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one?
4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one has a molecular weight of 290.75 g/mol, XLogP of 2.36, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloro-5-morpholin-3-ylphenyl)-1H-pyridin-2-one is sourced from PubChem (CID 171499292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).