1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one

C10H16N4O — CID 62929012

IUPAC1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one
SMILESCCn1ccnc(NC2CCNC2)c1=O
InChIInChI=1S/C10H16N4O/c1-2-14-6-5-12-9(10(14)15)13-8-3-4-11-7-8/h5-6,8,11H,2-4,7H2,1H3,(H,12,13)
InChIKeyHLJCORDURINCIJ-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.04
Rot. Bonds3

About 1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one

1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one (PubChem CID 62929012) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one.

Molecular Properties

Compound Name1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one
PubChem CID62929012
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one
SMILESCCn1ccnc(NC2CCNC2)c1=O
InChIInChI=1S/C10H16N4O/c1-2-14-6-5-12-9(10(14)15)13-8-3-4-11-7-8/h5-6,8,11H,2-4,7H2,1H3,(H,12,13)
InChIKeyHLJCORDURINCIJ-UHFFFAOYSA-N
XLogP0.04
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one?
The IUPAC name of 1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one (CID 62929012) is 1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one.
What is the SMILES notation for 1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one?
The canonical SMILES for 1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one is CCn1ccnc(NC2CCNC2)c1=O.
What is the InChIKey of 1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one?
The InChIKey is HLJCORDURINCIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-2-14-6-5-12-9(10(14)15)13-8-3-4-11-7-8/h5-6,8,11H,2-4,7H2,1H3,(H,12,13).
What are the key properties of 1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one?
1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one has a molecular weight of 208.26 g/mol, XLogP of 0.04, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(pyrrolidin-3-ylamino)pyrazin-2-one is sourced from PubChem (CID 62929012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).