10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione

C15H14N2O4 — CID 44539329

IUPAC10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione
SMILESCc1cc(=O)[nH]c2c(O)c3c(cc12)c(CO)cc(=O)n3C
InChIInChI=1S/C15H14N2O4/c1-7-3-11(19)16-13-9(7)5-10-8(6-18)4-12(20)17(2)14(10)15(13)21/h3-5,18,21H,6H2,1-2H3,(H,16,19)
InChIKeyKOLKVNKEAJWZES-UHFFFAOYSA-N
MW286.29 g/mol
LogP0.89
Rot. Bonds1

About 10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione

10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione (PubChem CID 44539329) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is 10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione.

Molecular Properties

Compound Name10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione
PubChem CID44539329
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC Name10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione
SMILESCc1cc(=O)[nH]c2c(O)c3c(cc12)c(CO)cc(=O)n3C
InChIInChI=1S/C15H14N2O4/c1-7-3-11(19)16-13-9(7)5-10-8(6-18)4-12(20)17(2)14(10)15(13)21/h3-5,18,21H,6H2,1-2H3,(H,16,19)
InChIKeyKOLKVNKEAJWZES-UHFFFAOYSA-N
XLogP0.89
TPSA95.32 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 50.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione?
The IUPAC name of 10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione (CID 44539329) is 10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione.
What is the SMILES notation for 10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione?
The canonical SMILES for 10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione is Cc1cc(=O)[nH]c2c(O)c3c(cc12)c(CO)cc(=O)n3C.
What is the InChIKey of 10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione?
The InChIKey is KOLKVNKEAJWZES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c1-7-3-11(19)16-13-9(7)5-10-8(6-18)4-12(20)17(2)14(10)15(13)21/h3-5,18,21H,6H2,1-2H3,(H,16,19).
What are the key properties of 10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione?
10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione has a molecular weight of 286.29 g/mol, XLogP of 0.89, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-hydroxy-4-(hydroxymethyl)-1,6-dimethyl-9H-pyrido[3,2-g]quinoline-2,8-dione is sourced from PubChem (CID 44539329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).