3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one

C14H24N4O — CID 81459890

IUPAC3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one
SMILESCCCn1ccnc(N2CCC(N)C(CC)C2)c1=O
InChIInChI=1S/C14H24N4O/c1-3-7-17-9-6-16-13(14(17)19)18-8-5-12(15)11(4-2)10-18/h6,9,11-12H,3-5,7-8,10,15H2,1-2H3
InChIKeyQMGJJGGEQBHXDX-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.22
Rot. Bonds4

About 3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one

3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one (PubChem CID 81459890) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one.

Molecular Properties

Compound Name3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one
PubChem CID81459890
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one
SMILESCCCn1ccnc(N2CCC(N)C(CC)C2)c1=O
InChIInChI=1S/C14H24N4O/c1-3-7-17-9-6-16-13(14(17)19)18-8-5-12(15)11(4-2)10-18/h6,9,11-12H,3-5,7-8,10,15H2,1-2H3
InChIKeyQMGJJGGEQBHXDX-UHFFFAOYSA-N
XLogP1.22
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-aminopiperidin-1-yl)-1-propylpyrazin-2-one
CID 62939071
3-[(3R)-3-aminopiperidin-1-yl]-1-propylpyrazin-2-one
CID 102986648
3-[3-(bromomethyl)pyrrolidin-1-yl]-1-propylpyrazin-2-one
CID 80680208
3-(3-aminopyrrolidin-1-yl)-1-ethylpyrazin-2-one
CID 62928142
3-[4-(1-bromoethyl)piperidin-1-yl]-1-propylpyrazin-2-one
CID 106838619
3-piperazin-1-yl-1-propylpyrazin-2-one
CID 62938367
3-[4-(2-chloroethoxy)piperidin-1-yl]-1-propylpyrazin-2-one
CID 82701749
3-(4-amino-2-methylpiperidin-1-yl)-1-propylpyrazin-2-one
CID 115313461
2-[1-(3-oxo-4-propylpyrazin-2-yl)azetidin-3-yl]acetic acid
CID 64618257
3-ethyl-1-[1-(3-methoxypropyl)imidazol-2-yl]piperidin-4-amine
CID 106553250
3-[4-(1-aminopropan-2-yl)piperazin-1-yl]-1-propylpyrazin-2-one
CID 63339249
3-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-1-propylpyrazin-2-one
CID 102683989

Frequently Asked Questions

What is the IUPAC name of 3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one?
The IUPAC name of 3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one (CID 81459890) is 3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one.
What is the SMILES notation for 3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one?
The canonical SMILES for 3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one is CCCn1ccnc(N2CCC(N)C(CC)C2)c1=O.
What is the InChIKey of 3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one?
The InChIKey is QMGJJGGEQBHXDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-7-17-9-6-16-13(14(17)19)18-8-5-12(15)11(4-2)10-18/h6,9,11-12H,3-5,7-8,10,15H2,1-2H3.
What are the key properties of 3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one?
3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one has a molecular weight of 264.37 g/mol, XLogP of 1.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-amino-3-ethylpiperidin-1-yl)-1-propylpyrazin-2-one is sourced from PubChem (CID 81459890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).