8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one

C19H16ClNO3 — CID 23586741

IUPAC8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one
SMILESO=c1cc(N2CCOCC2)oc2c(-c3ccccc3Cl)cccc12
InChIInChI=1S/C19H16ClNO3/c20-16-7-2-1-4-13(16)14-5-3-6-15-17(22)12-18(24-19(14)15)21-8-10-23-11-9-21/h1-7,12H,8-11H2
InChIKeyLSQASIDEPGAHAB-UHFFFAOYSA-N
MW341.79 g/mol
LogP3.95
Rot. Bonds2

About 8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one

8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one (PubChem CID 23586741) has the molecular formula C19H16ClNO3 and a molecular weight of 341.79 g/mol. Its IUPAC name is 8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one.

Molecular Properties

Compound Name8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one
PubChem CID23586741
Molecular FormulaC19H16ClNO3
Molecular Weight341.79 g/mol
Exact Mass341.08
IUPAC Name8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one
SMILESO=c1cc(N2CCOCC2)oc2c(-c3ccccc3Cl)cccc12
InChIInChI=1S/C19H16ClNO3/c20-16-7-2-1-4-13(16)14-5-3-6-15-17(22)12-18(24-19(14)15)21-8-10-23-11-9-21/h1-7,12H,8-11H2
InChIKeyLSQASIDEPGAHAB-UHFFFAOYSA-N
XLogP3.95
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.79
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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2-Morpholin-4-yl-6-phenyl-chromen-4-one
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8-(4-Chlorophenyl)-2-morpholin-4-ylchromen-4-one
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Frequently Asked Questions

What is the IUPAC name of 8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one?
The IUPAC name of 8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one (CID 23586741) is 8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one.
What is the SMILES notation for 8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one?
The canonical SMILES for 8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one is O=c1cc(N2CCOCC2)oc2c(-c3ccccc3Cl)cccc12.
What is the InChIKey of 8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one?
The InChIKey is LSQASIDEPGAHAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClNO3/c20-16-7-2-1-4-13(16)14-5-3-6-15-17(22)12-18(24-19(14)15)21-8-10-23-11-9-21/h1-7,12H,8-11H2.
What are the key properties of 8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one?
8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one has a molecular weight of 341.79 g/mol, XLogP of 3.95, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-chlorophenyl)-2-morpholin-4-ylchromen-4-one is sourced from PubChem (CID 23586741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).