N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide

C15H17N3O3 — CID 20910160

IUPACN-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide
SMILESCn1cc(NC(=O)N2CCOCC2)c2ccccc2c1=O
InChIInChI=1S/C15H17N3O3/c1-17-10-13(11-4-2-3-5-12(11)14(17)19)16-15(20)18-6-8-21-9-7-18/h2-5,10H,6-9H2,1H3,(H,16,20)
InChIKeyJLLDQXKDJOWCJV-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.40
Rot. Bonds1

About N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide

N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide (PubChem CID 20910160) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide
PubChem CID20910160
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC NameN-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide
SMILESCn1cc(NC(=O)N2CCOCC2)c2ccccc2c1=O
InChIInChI=1S/C15H17N3O3/c1-17-10-13(11-4-2-3-5-12(11)14(17)19)16-15(20)18-6-8-21-9-7-18/h2-5,10H,6-9H2,1H3,(H,16,20)
InChIKeyJLLDQXKDJOWCJV-UHFFFAOYSA-N
XLogP1.40
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide 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

N-(2-methyl-1-oxoisoquinolin-4-yl)-4-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide
CID 20910199
N-(2-propan-2-ylphenyl)morpholine-4-carboxamide
CID 3684146
1-cyclohexyl-3-(2-methyl-1-oxoisoquinolin-4-yl)urea
CID 6624970
ethane;2-methyl-4-(methylamino)isoquinolin-1-one
CID 142426348
N-(2-fluoro-3-methylphenyl)morpholine-4-carboxamide
CID 166178432
1-(5-methyl-1,2-oxazol-3-yl)-3-(2-methyl-1-oxoisoquinolin-4-yl)urea
CID 6625823
N-(1-cyanonaphthalen-2-yl)morpholine-4-carboxamide
CID 12758540
(3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide
CID 42551679
N-[3-(morpholine-4-carbonylamino)phenyl]morpholine-4-carboxamide
CID 171576986
1-methyl-N-[2-(pyrrolidine-1-carbonylamino)phenyl]indole-3-carboxamide
CID 55736422
N-(3-acetamidophenyl)morpholine-4-carboxamide
CID 3707113
2-hydroxy-3-(1,4-oxazepane-4-carbonylamino)benzoic acid
CID 104833689

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide?
The IUPAC name of N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide (CID 20910160) is N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide?
The canonical SMILES for N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide is Cn1cc(NC(=O)N2CCOCC2)c2ccccc2c1=O.
What is the InChIKey of N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide?
The InChIKey is JLLDQXKDJOWCJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-17-10-13(11-4-2-3-5-12(11)14(17)19)16-15(20)18-6-8-21-9-7-18/h2-5,10H,6-9H2,1H3,(H,16,20).
What are the key properties of N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide?
N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 1.40, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-oxoisoquinolin-4-yl)morpholine-4-carboxamide is sourced from PubChem (CID 20910160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).