1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one

C14H16N4O — CID 114700807

IUPAC1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one
SMILESCc1cnccc1CNc1nccn(C2CC2)c1=O
InChIInChI=1S/C14H16N4O/c1-10-8-15-5-4-11(10)9-17-13-14(19)18(7-6-16-13)12-2-3-12/h4-8,12H,2-3,9H2,1H3,(H,16,17)
InChIKeyFSLUQGWZGPVAJB-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.89
Rot. Bonds4

About 1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one

1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one (PubChem CID 114700807) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is 1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one
PubChem CID114700807
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC Name1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one
SMILESCc1cnccc1CNc1nccn(C2CC2)c1=O
InChIInChI=1S/C14H16N4O/c1-10-8-15-5-4-11(10)9-17-13-14(19)18(7-6-16-13)12-2-3-12/h4-8,12H,2-3,9H2,1H3,(H,16,17)
InChIKeyFSLUQGWZGPVAJB-UHFFFAOYSA-N
XLogP1.89
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(3-methyl-4-pyridinyl)methylamino]-1-propylpyrazin-2-one
CID 114701033
1-cyclopropyl-3-[(5-methylpyrazin-2-yl)methylamino]pyrazin-2-one
CID 62928293
1-cyclopropyl-3-[(5-methylthiophen-2-yl)methylamino]pyrazin-2-one
CID 55154886
1-cyclopropyl-3-[(3-ethyl-2-pyridinyl)methylamino]pyrazin-2-one
CID 82740294
1-cyclopropyl-3-(propylamino)pyrazin-2-one
CID 62938241
1-cyclopropyl-3-(2,3,3-trimethylbutylamino)pyrazin-2-one
CID 83144354
1-cyclopropyl-3-[(5-ethyl-1,3-oxazol-2-yl)methylamino]pyrazin-2-one
CID 106898477
1-cyclopropyl-3-[(1-ethylcyclopropyl)methylamino]pyrazin-2-one
CID 103931036
2-[(4-cyclopropyl-3-oxopyrazin-2-yl)amino]-N,N-dimethylacetamide
CID 62940892
3-(4-chlorobutylamino)-1-cyclopropylpyrazin-2-one
CID 106845044
1-cyclopropyl-3-[(1-hydroxy-4-methylcyclohexyl)methylamino]pyrazin-2-one
CID 65118452
1-cyclopropyl-3-(2-phenylpropylamino)pyrazin-2-one
CID 115917119

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one?
The IUPAC name of 1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one (CID 114700807) is 1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one.
What is the SMILES notation for 1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one?
The canonical SMILES for 1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one is Cc1cnccc1CNc1nccn(C2CC2)c1=O.
What is the InChIKey of 1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one?
The InChIKey is FSLUQGWZGPVAJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-10-8-15-5-4-11(10)9-17-13-14(19)18(7-6-16-13)12-2-3-12/h4-8,12H,2-3,9H2,1H3,(H,16,17).
What are the key properties of 1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one?
1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one has a molecular weight of 256.31 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[(3-methyl-4-pyridinyl)methylamino]pyrazin-2-one is sourced from PubChem (CID 114700807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).