6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one

C25H23N5O3 — CID 118224657

IUPAC6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one
SMILESCOc1cc2c(ccc(=O)n2Cc2ccc(-c3cnn(C)c3)cn2)cc1-c1c(C)noc1C
InChIInChI=1S/C25H23N5O3/c1-15-25(16(2)33-28-15)21-9-17-6-8-24(31)30(22(17)10-23(21)32-4)14-20-7-5-18(11-26-20)19-12-27-29(3)13-19/h5-13H,14H2,1-4H3
InChIKeyNYUQSBMYDSDDRN-UHFFFAOYSA-N
MW441.49 g/mol
LogP4.13
Rot. Bonds5

About 6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one

6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one (PubChem CID 118224657) has the molecular formula C25H23N5O3 and a molecular weight of 441.49 g/mol. Its IUPAC name is 6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one.

Molecular Properties

Compound Name6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one
PubChem CID118224657
Molecular FormulaC25H23N5O3
Molecular Weight441.49 g/mol
Exact Mass441.18
IUPAC Name6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one
SMILESCOc1cc2c(ccc(=O)n2Cc2ccc(-c3cnn(C)c3)cn2)cc1-c1c(C)noc1C
InChIInChI=1S/C25H23N5O3/c1-15-25(16(2)33-28-15)21-9-17-6-8-24(31)30(22(17)10-23(21)32-4)14-20-7-5-18(11-26-20)19-12-27-29(3)13-19/h5-13H,14H2,1-4H3
InChIKeyNYUQSBMYDSDDRN-UHFFFAOYSA-N
XLogP4.13
TPSA87.97 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500441.49
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-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

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one?
The IUPAC name of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one (CID 118224657) is 6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one.
What is the SMILES notation for 6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one?
The canonical SMILES for 6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one is COc1cc2c(ccc(=O)n2Cc2ccc(-c3cnn(C)c3)cn2)cc1-c1c(C)noc1C.
What is the InChIKey of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one?
The InChIKey is NYUQSBMYDSDDRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N5O3/c1-15-25(16(2)33-28-15)21-9-17-6-8-24(31)30(22(17)10-23(21)32-4)14-20-7-5-18(11-26-20)19-12-27-29(3)13-19/h5-13H,14H2,1-4H3.
What are the key properties of 6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one?
6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one has a molecular weight of 441.49 g/mol, XLogP of 4.13, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-[[5-(1-methylpyrazol-4-yl)-2-pyridinyl]methyl]quinolin-2-one is sourced from PubChem (CID 118224657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).