4-morpholin-4-ylbenzo[g]chromen-2-one

C17H15NO3 — CID 11346540

IUPAC4-morpholin-4-ylbenzo[g]chromen-2-one
SMILESO=c1cc(N2CCOCC2)c2cc3ccccc3cc2o1
InChIInChI=1S/C17H15NO3/c19-17-11-15(18-5-7-20-8-6-18)14-9-12-3-1-2-4-13(12)10-16(14)21-17/h1-4,9-11H,5-8H2
InChIKeyNEEAOCHOCYXDSE-UHFFFAOYSA-N
MW281.31 g/mol
LogP2.78
Rot. Bonds1

About 4-morpholin-4-ylbenzo[g]chromen-2-one

4-morpholin-4-ylbenzo[g]chromen-2-one (PubChem CID 11346540) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is 4-morpholin-4-ylbenzo[g]chromen-2-one.

Molecular Properties

Compound Name4-morpholin-4-ylbenzo[g]chromen-2-one
PubChem CID11346540
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC Name4-morpholin-4-ylbenzo[g]chromen-2-one
SMILESO=c1cc(N2CCOCC2)c2cc3ccccc3cc2o1
InChIInChI=1S/C17H15NO3/c19-17-11-15(18-5-7-20-8-6-18)14-9-12-3-1-2-4-13(12)10-16(14)21-17/h1-4,9-11H,5-8H2
InChIKeyNEEAOCHOCYXDSE-UHFFFAOYSA-N
XLogP2.78
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 4-morpholin-4-ylbenzo[g]chromen-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-morpholin-4-yl-7-phenylchromen-2-one
CID 46891260
3-morpholin-4-ylnaphthalene-2-thiol
CID 91552952
7-methyl-4-[[methyl-[(2-morpholin-4-ylphenyl)methyl]amino]methyl]chromen-2-one
CID 25482662
4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylchromen-2-one
CID 44561858
4-(4-benzylpiperazin-1-yl)benzo[h]chromen-2-one
CID 155532553
4-[4-(4-chlorophenyl)piperazin-1-yl]benzo[h]chromen-2-one
CID 155513549
[2-(1,1-dimethoxyethyl)benzo[f][1]benzofuran-3-yl]-morpholin-4-ylmethanone
CID 129245002
5-ethyl-6-methyl-4-morpholin-4-ylpyran-2-one
CID 121012939
8-amino-3-morpholin-4-yl-1H-quinolin-2-one
CID 68704014
4-morpholin-4-yl-3-phenyl-1H-pyridazin-6-one
CID 3770299
CID 123696808
CID 123696808
anthracene;4-sulfanylmorpholine
CID 157389683

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-ylbenzo[g]chromen-2-one?
The IUPAC name of 4-morpholin-4-ylbenzo[g]chromen-2-one (CID 11346540) is 4-morpholin-4-ylbenzo[g]chromen-2-one.
What is the SMILES notation for 4-morpholin-4-ylbenzo[g]chromen-2-one?
The canonical SMILES for 4-morpholin-4-ylbenzo[g]chromen-2-one is O=c1cc(N2CCOCC2)c2cc3ccccc3cc2o1.
What is the InChIKey of 4-morpholin-4-ylbenzo[g]chromen-2-one?
The InChIKey is NEEAOCHOCYXDSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3/c19-17-11-15(18-5-7-20-8-6-18)14-9-12-3-1-2-4-13(12)10-16(14)21-17/h1-4,9-11H,5-8H2.
What are the key properties of 4-morpholin-4-ylbenzo[g]chromen-2-one?
4-morpholin-4-ylbenzo[g]chromen-2-one has a molecular weight of 281.31 g/mol, XLogP of 2.78, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-ylbenzo[g]chromen-2-one is sourced from PubChem (CID 11346540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).