3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one

C14H25N5O — CID 63339249

IUPAC3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one
SMILESCCCn1ccnc(N2CCN(C(C)CN)CC2)c1=O
InChIInChI=1S/C14H25N5O/c1-3-5-19-6-4-16-13(14(19)20)18-9-7-17(8-10-18)12(2)11-15/h4,6,12H,3,5,7-11,15H2,1-2H3
InChIKeyFNLLERJGAVSTNZ-UHFFFAOYSA-N
MW279.39 g/mol
LogP0.12
Rot. Bonds5

About 3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one

3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one (PubChem CID 63339249) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is 3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one.

Molecular Properties

Compound Name3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one
PubChem CID63339249
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC Name3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one
SMILESCCCn1ccnc(N2CCN(C(C)CN)CC2)c1=O
InChIInChI=1S/C14H25N5O/c1-3-5-19-6-4-16-13(14(19)20)18-9-7-17(8-10-18)12(2)11-15/h4,6,12H,3,5,7-11,15H2,1-2H3
InChIKeyFNLLERJGAVSTNZ-UHFFFAOYSA-N
XLogP0.12
TPSA67.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-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-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propan-2-ylpyrazin-2-one
CID 63339161
3-(4-aminopiperidin-1-yl)-1-propylpyrazin-2-one
CID 62939071
3-piperazin-1-yl-1-propylpyrazin-2-one
CID 62938367
3-[4-(1-bromoethyl)piperidin-1-yl]-1-propylpyrazin-2-one
CID 106838619
3-[4-(1-aminopentan-2-yl)piperazin-1-yl]-1-methylpyrazin-2-one
CID 63339478
3-[(3R)-3-aminopiperidin-1-yl]-1-propylpyrazin-2-one
CID 102986648
3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one
CID 81459890
4-methyl-1-(3-oxo-4-propylpyrazin-2-yl)piperidine-4-carboximidamide
CID 107162190
3-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-1-ethylpyrazin-2-one
CID 55219868
3-[3-(bromomethyl)pyrrolidin-1-yl]-1-propylpyrazin-2-one
CID 80680208
3-[4-(2-chloroethoxy)piperidin-1-yl]-1-propylpyrazin-2-one
CID 82701749
2-[1-(3-oxo-4-propylpyrazin-2-yl)azetidin-3-yl]acetic acid
CID 64618257

Frequently Asked Questions

What is the IUPAC name of 3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one?
The IUPAC name of 3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one (CID 63339249) is 3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one.
What is the SMILES notation for 3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one?
The canonical SMILES for 3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one is CCCn1ccnc(N2CCN(C(C)CN)CC2)c1=O.
What is the InChIKey of 3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one?
The InChIKey is FNLLERJGAVSTNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-3-5-19-6-4-16-13(14(19)20)18-9-7-17(8-10-18)12(2)11-15/h4,6,12H,3,5,7-11,15H2,1-2H3.
What are the key properties of 3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one?
3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one has a molecular weight of 279.39 g/mol, XLogP of 0.12, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one is sourced from PubChem (CID 63339249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).