3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one

C10H17N3O2 — CID 62939228

IUPAC3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one
SMILESCOCC(C)CNc1nccn(C)c1=O
InChIInChI=1S/C10H17N3O2/c1-8(7-15-3)6-12-9-10(14)13(2)5-4-11-9/h4-5,8H,6-7H2,1-3H3,(H,11,12)
InChIKeyWZFOFFMDIFPNKC-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.47
Rot. Bonds5

About 3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one

3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one (PubChem CID 62939228) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one.

Molecular Properties

Compound Name3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one
PubChem CID62939228
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one
SMILESCOCC(C)CNc1nccn(C)c1=O
InChIInChI=1S/C10H17N3O2/c1-8(7-15-3)6-12-9-10(14)13(2)5-4-11-9/h4-5,8H,6-7H2,1-3H3,(H,11,12)
InChIKeyWZFOFFMDIFPNKC-UHFFFAOYSA-N
XLogP0.47
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-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

3-[(2-chloro-3-methoxypropyl)amino]-1-methylpyrazin-2-one
CID 65027955
1-methyl-3-(2-methylbutylamino)pyrazin-2-one
CID 62938700
3-[(3-methoxy-2-methylpropyl)amino]-1-(2-methylpropyl)pyrazin-2-one
CID 62929149
3-[(3-amino-2-methylpropyl)amino]-1-methylpyrazin-2-one
CID 65034860
3-(3-methoxypropylamino)-1-methylpyrazin-2-one
CID 62939042
3-[(2-chloro-3-methoxypropyl)amino]-1-propan-2-ylpyrazin-2-one
CID 65027172
3-[(2-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one
CID 115658440
3-[(3-methoxy-2-methylpropyl)amino]-1H-pyrazin-2-one
CID 115657236
N-(3-methoxy-2-methylpropyl)-1-methylimidazo[4,5-c]pyridin-4-amine
CID 103385555
3-[(2-chloro-2-phenylethyl)amino]-1-methylpyrazin-2-one
CID 65027751
3-[(2-amino-2-cyclopropylethyl)amino]-1-methylpyrazin-2-one
CID 63760635
3-[[(2R)-2-(2-bromophenoxy)propyl]amino]-1-methylpyrazin-2-one
CID 97221043

Frequently Asked Questions

What is the IUPAC name of 3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one?
The IUPAC name of 3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one (CID 62939228) is 3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one.
What is the SMILES notation for 3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one?
The canonical SMILES for 3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one is COCC(C)CNc1nccn(C)c1=O.
What is the InChIKey of 3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one?
The InChIKey is WZFOFFMDIFPNKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-8(7-15-3)6-12-9-10(14)13(2)5-4-11-9/h4-5,8H,6-7H2,1-3H3,(H,11,12).
What are the key properties of 3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one?
3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one has a molecular weight of 211.26 g/mol, XLogP of 0.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-methoxy-2-methylpropyl)amino]-1-methylpyrazin-2-one is sourced from PubChem (CID 62939228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).