6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one

C14H12N2O2 — CID 82046249

IUPAC6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one
SMILESNc1ccc2c(c1)C(=O)CC(c1ccccn1)O2
InChIInChI=1S/C14H12N2O2/c15-9-4-5-13-10(7-9)12(17)8-14(18-13)11-3-1-2-6-16-11/h1-7,14H,8,15H2
InChIKeyVRPZAMSYISXOAF-UHFFFAOYSA-N
MW240.26 g/mol
LogP2.37
Rot. Bonds1

About 6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one

6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one (PubChem CID 82046249) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is 6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one.

Molecular Properties

Compound Name6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one
PubChem CID82046249
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC Name6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one
SMILESNc1ccc2c(c1)C(=O)CC(c1ccccn1)O2
InChIInChI=1S/C14H12N2O2/c15-9-4-5-13-10(7-9)12(17)8-14(18-13)11-3-1-2-6-16-11/h1-7,14H,8,15H2
InChIKeyVRPZAMSYISXOAF-UHFFFAOYSA-N
XLogP2.37
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-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

6-amino-2-(4-chlorophenyl)-2,3-dihydrochromen-4-one
CID 82046236
6-aminooxy-2-phenyl-2,3-dihydrochromen-4-one
CID 163678312
(2S)-6-bromo-2-phenyl-2,3-dihydrochromen-4-one
CID 71059551
6-hydroxy-2-(3-pyridin-2-yloxyphenyl)-2,3-dihydrochromen-4-one
CID 69016686
5-amino-1-benzofuran-3-one
CID 51138323
4-oxo-2-phenyl-2,3-dihydrochromene-6-carboxylic acid
CID 5270553
2-(3-pyridin-2-yloxyphenyl)-2,3-dihydrochromen-4-one
CID 142675803
(2R)-6-bromo-2-pyridin-3-yl-2,3-dihydrochromen-4-one
CID 40901085
7-[(5-amino-2-pyridinyl)oxy]-2-phenyl-2,3-dihydrochromen-4-one
CID 69016863
2-(4-chloroquinolin-2-yl)-2,3-dihydrochromen-4-one
CID 132571075
6-bromo-2-(2-fluorophenyl)-2,3-dihydrochromen-4-one
CID 58424087
6-fluoro-2-(2-methylphenyl)-2,3-dihydrochromen-4-one
CID 114671977

Frequently Asked Questions

What is the IUPAC name of 6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one?
The IUPAC name of 6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one (CID 82046249) is 6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one.
What is the SMILES notation for 6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one?
The canonical SMILES for 6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one is Nc1ccc2c(c1)C(=O)CC(c1ccccn1)O2.
What is the InChIKey of 6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one?
The InChIKey is VRPZAMSYISXOAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2/c15-9-4-5-13-10(7-9)12(17)8-14(18-13)11-3-1-2-6-16-11/h1-7,14H,8,15H2.
What are the key properties of 6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one?
6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one has a molecular weight of 240.26 g/mol, XLogP of 2.37, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-pyridin-2-yl-2,3-dihydrochromen-4-one is sourced from PubChem (CID 82046249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).