7-(dimethylamino)-3-phenylchromen-2-one

C17H15NO2 — CID 10611726

IUPAC7-(dimethylamino)-3-phenylchromen-2-one
SMILESCN(C)c1ccc2cc(-c3ccccc3)c(=O)oc2c1
InChIInChI=1S/C17H15NO2/c1-18(2)14-9-8-13-10-15(12-6-4-3-5-7-12)17(19)20-16(13)11-14/h3-11H,1-2H3
InChIKeyRHWPEOUEWCKBTJ-UHFFFAOYSA-N
MW265.31 g/mol
LogP3.53
Rot. Bonds2

About 7-(dimethylamino)-3-phenylchromen-2-one

7-(dimethylamino)-3-phenylchromen-2-one (PubChem CID 10611726) has the molecular formula C17H15NO2 and a molecular weight of 265.31 g/mol. Its IUPAC name is 7-(dimethylamino)-3-phenylchromen-2-one.

Molecular Properties

Compound Name7-(dimethylamino)-3-phenylchromen-2-one
PubChem CID10611726
Molecular FormulaC17H15NO2
Molecular Weight265.31 g/mol
Exact Mass265.11
IUPAC Name7-(dimethylamino)-3-phenylchromen-2-one
SMILESCN(C)c1ccc2cc(-c3ccccc3)c(=O)oc2c1
InChIInChI=1S/C17H15NO2/c1-18(2)14-9-8-13-10-15(12-6-4-3-5-7-12)17(19)20-16(13)11-14/h3-11H,1-2H3
InChIKeyRHWPEOUEWCKBTJ-UHFFFAOYSA-N
XLogP3.53
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 7-(dimethylamino)-3-phenylchromen-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

3-(1-benzylpyridin-1-ium-4-yl)-7-(dimethylamino)chromen-2-one
CID 87648362
7-(dimethylamino)-3-[1-(2-hydroxyethyl)pyridin-1-ium-4-yl]chromen-2-one
CID 87648151
7-(dimethylamino)-3-pyrimidin-2-ylchromen-2-one
CID 58667740
7-(dimethylamino)-3-(1-methylpyridin-1-ium-4-yl)chromen-2-one;hydrogen sulfate
CID 87649960
7-(dimethylamino)-3-(1-prop-2-enylpyridin-1-ium-4-yl)chromen-2-one
CID 87648388
3-[6-(dimethylamino)-1-benzofuran-2-yl]-4-phenylpyrrole-2,5-dione
CID 70452206
3-phenylchromen-2-one;hydrochloride
CID 141206894
7-(dimethylamino)-3-(1-methylbenzimidazol-2-yl)chromen-2-one
CID 87679527
7-(diethylamino)-3-[4-(N-naphthalen-1-ylanilino)phenyl]chromen-2-one
CID 58612991
7-(diethylamino)-3-(3-methylphenyl)chromen-2-one
CID 87585315
7-(furan-2-yl)-3-phenylchromen-2-one
CID 59685532
3-(3-chlorophenyl)-7-(diethylamino)chromen-2-one
CID 3518661

Frequently Asked Questions

What is the IUPAC name of 7-(dimethylamino)-3-phenylchromen-2-one?
The IUPAC name of 7-(dimethylamino)-3-phenylchromen-2-one (CID 10611726) is 7-(dimethylamino)-3-phenylchromen-2-one.
What is the SMILES notation for 7-(dimethylamino)-3-phenylchromen-2-one?
The canonical SMILES for 7-(dimethylamino)-3-phenylchromen-2-one is CN(C)c1ccc2cc(-c3ccccc3)c(=O)oc2c1.
What is the InChIKey of 7-(dimethylamino)-3-phenylchromen-2-one?
The InChIKey is RHWPEOUEWCKBTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2/c1-18(2)14-9-8-13-10-15(12-6-4-3-5-7-12)17(19)20-16(13)11-14/h3-11H,1-2H3.
What are the key properties of 7-(dimethylamino)-3-phenylchromen-2-one?
7-(dimethylamino)-3-phenylchromen-2-one has a molecular weight of 265.31 g/mol, XLogP of 3.53, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(dimethylamino)-3-phenylchromen-2-one is sourced from PubChem (CID 10611726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).