1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one

C12H19N3O2 — CID 62928461

IUPAC1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one
SMILESCCn1ccnc(NC2CCCC2OC)c1=O
InChIInChI=1S/C12H19N3O2/c1-3-15-8-7-13-11(12(15)16)14-9-5-4-6-10(9)17-2/h7-10H,3-6H2,1-2H3,(H,13,14)
InChIKeyNLZIUDPPSPWBKI-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.24
Rot. Bonds4

About 1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one

1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one (PubChem CID 62928461) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one.

Molecular Properties

Compound Name1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one
PubChem CID62928461
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one
SMILESCCn1ccnc(NC2CCCC2OC)c1=O
InChIInChI=1S/C12H19N3O2/c1-3-15-8-7-13-11(12(15)16)14-9-5-4-6-10(9)17-2/h7-10H,3-6H2,1-2H3,(H,13,14)
InChIKeyNLZIUDPPSPWBKI-UHFFFAOYSA-N
XLogP1.24
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-3-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ylamino)pyrazin-2-one
CID 62927230
3-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-ylamino)-1-ethylpyrazin-2-one
CID 62939189
3-[(2-aminocyclopentyl)amino]-1-propylpyrazin-2-one
CID 63252226
1-ethyl-3-[(3-methylsulfanylcyclohexyl)amino]pyrazin-2-one
CID 113349521
N-(2-methoxycyclopentyl)-1-(3-methoxypropyl)imidazol-2-amine
CID 106569905
3-[[2-(chloromethyl)cyclohexyl]amino]-1-propylpyrazin-2-one
CID 106365605
ethyl 4-[(4-ethyl-3-oxopyrazin-2-yl)amino]piperidine-1-carboxylate
CID 62938971
3-[(2-aminocycloheptyl)amino]-1-(2-methylpropyl)pyrazin-2-one
CID 63258805
1-ethyl-3-[(3-hydroxycyclohexyl)methylamino]pyrazin-2-one
CID 113349523
2-cyclohexyl-2-[(4-ethyl-3-oxopyrazin-2-yl)amino]acetic acid
CID 62940470
N-(2-methoxycyclopentyl)-1-phenylimidazol-2-amine
CID 106569919
3-[(2-methyloxolan-3-yl)amino]-1-propylpyrazin-2-one
CID 82728930

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one?
The IUPAC name of 1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one (CID 62928461) is 1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one.
What is the SMILES notation for 1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one?
The canonical SMILES for 1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one is CCn1ccnc(NC2CCCC2OC)c1=O.
What is the InChIKey of 1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one?
The InChIKey is NLZIUDPPSPWBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-3-15-8-7-13-11(12(15)16)14-9-5-4-6-10(9)17-2/h7-10H,3-6H2,1-2H3,(H,13,14).
What are the key properties of 1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one?
1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one has a molecular weight of 237.30 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[(2-methoxycyclopentyl)amino]pyrazin-2-one is sourced from PubChem (CID 62928461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).