3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one

C10H12N4O2 — CID 115657215

IUPAC3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one
SMILESCc1noc(C)c1CNc1ncc[nH]c1=O
InChIInChI=1S/C10H12N4O2/c1-6-8(7(2)16-14-6)5-13-9-10(15)12-4-3-11-9/h3-4H,5H2,1-2H3,(H,11,13)(H,12,15)
InChIKeyIUEJWOLNLVMSJP-UHFFFAOYSA-N
MW220.23 g/mol
LogP0.99
Rot. Bonds3

About 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one

3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one (PubChem CID 115657215) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one.

Molecular Properties

Compound Name3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one
PubChem CID115657215
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC Name3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one
SMILESCc1noc(C)c1CNc1ncc[nH]c1=O
InChIInChI=1S/C10H12N4O2/c1-6-8(7(2)16-14-6)5-13-9-10(15)12-4-3-11-9/h3-4H,5H2,1-2H3,(H,11,13)(H,12,15)
InChIKeyIUEJWOLNLVMSJP-UHFFFAOYSA-N
XLogP0.99
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-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

6-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 78974609
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
CID 47077228
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
CID 79099269
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-methoxy-5-methylpyrimidin-4-amine
CID 79241724
4-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-N-methyl-5-propan-2-ylpyrimidine-4,6-diamine
CID 80848891
6-chloro-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-nitropyrimidin-4-amine
CID 79238315
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1H-pyrazol-4-amine
CID 43539826
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-7-methoxyisoquinolin-1-amine
CID 106539045
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5,6-dimethylpyrazin-2-amine
CID 114475971
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-methyl-3-nitropyridin-2-amine
CID 79035565
3-[(2-methoxyphenyl)methylamino]-1H-pyrazin-2-one
CID 115650170
3-[3-(dimethylamino)propylamino]-1H-pyrazin-2-one
CID 114568070

Frequently Asked Questions

What is the IUPAC name of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one?
The IUPAC name of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one (CID 115657215) is 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one.
What is the SMILES notation for 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one?
The canonical SMILES for 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one is Cc1noc(C)c1CNc1ncc[nH]c1=O.
What is the InChIKey of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one?
The InChIKey is IUEJWOLNLVMSJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-6-8(7(2)16-14-6)5-13-9-10(15)12-4-3-11-9/h3-4H,5H2,1-2H3,(H,11,13)(H,12,15).
What are the key properties of 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one?
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one has a molecular weight of 220.23 g/mol, XLogP of 0.99, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methylamino]-1H-pyrazin-2-one is sourced from PubChem (CID 115657215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).