2-morpholin-4-yl-8-phenylchromen-4-one

C19H17NO3 — CID 3973

IUPAC2-morpholin-4-yl-8-phenylchromen-4-one
SMILESO=c1cc(N2CCOCC2)oc2c(-c3ccccc3)cccc12
InChIInChI=1S/C19H17NO3/c21-17-13-18(20-9-11-22-12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2
InChIKeyCZQHHVNHHHRRDU-UHFFFAOYSA-N
MW307.35 g/mol
LogP3.30
Rot. Bonds2

About 2-morpholin-4-yl-8-phenylchromen-4-one

2-morpholin-4-yl-8-phenylchromen-4-one (PubChem CID 3973) has the molecular formula C19H17NO3 and a molecular weight of 307.35 g/mol. Its IUPAC name is 2-morpholin-4-yl-8-phenylchromen-4-one.

Molecular Properties

Compound Name2-morpholin-4-yl-8-phenylchromen-4-one
PubChem CID3973
Molecular FormulaC19H17NO3
Molecular Weight307.35 g/mol
Exact Mass307.12
IUPAC Name2-morpholin-4-yl-8-phenylchromen-4-one
SMILESO=c1cc(N2CCOCC2)oc2c(-c3ccccc3)cccc12
InChIInChI=1S/C19H17NO3/c21-17-13-18(20-9-11-22-12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2
InChIKeyCZQHHVNHHHRRDU-UHFFFAOYSA-N
XLogP3.30
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-8-phenylchromen-4-one?
The IUPAC name of 2-morpholin-4-yl-8-phenylchromen-4-one (CID 3973) is 2-morpholin-4-yl-8-phenylchromen-4-one.
What is the SMILES notation for 2-morpholin-4-yl-8-phenylchromen-4-one?
The canonical SMILES for 2-morpholin-4-yl-8-phenylchromen-4-one is O=c1cc(N2CCOCC2)oc2c(-c3ccccc3)cccc12.
What is the InChIKey of 2-morpholin-4-yl-8-phenylchromen-4-one?
The InChIKey is CZQHHVNHHHRRDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO3/c21-17-13-18(20-9-11-22-12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2.
What are the key properties of 2-morpholin-4-yl-8-phenylchromen-4-one?
2-morpholin-4-yl-8-phenylchromen-4-one has a molecular weight of 307.35 g/mol, XLogP of 3.30, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-8-phenylchromen-4-one is sourced from PubChem (CID 3973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).