3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one

C9H14N4O — CID 114570941

IUPAC3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one
SMILESNC1CCCC1Nc1ncc[nH]c1=O
InChIInChI=1S/C9H14N4O/c10-6-2-1-3-7(6)13-8-9(14)12-5-4-11-8/h4-7H,1-3,10H2,(H,11,13)(H,12,14)
InChIKeyZBNKJJSIPCQJIZ-UHFFFAOYSA-N
MW194.24 g/mol
LogP0.06
Rot. Bonds2

About 3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one

3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one (PubChem CID 114570941) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is 3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one.

Molecular Properties

Compound Name3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one
PubChem CID114570941
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC Name3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one
SMILESNC1CCCC1Nc1ncc[nH]c1=O
InChIInChI=1S/C9H14N4O/c10-6-2-1-3-7(6)13-8-9(14)12-5-4-11-8/h4-7H,1-3,10H2,(H,11,13)(H,12,14)
InChIKeyZBNKJJSIPCQJIZ-UHFFFAOYSA-N
XLogP0.06
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 50.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[2-(hydroxymethyl)cyclopentyl]amino]-1H-pyrazin-2-one
CID 103703713
3-[(2,3-dimethylcyclohexyl)amino]-1H-pyrazin-2-one
CID 115677773
3-[(2-methyloxolan-3-yl)amino]-1H-pyrazin-2-one
CID 115868834
3-(7-oxabicyclo[2.2.1]heptan-2-ylamino)-1H-pyrazin-2-one
CID 115694801
3-[(4-methylcyclohexyl)amino]-1H-pyrazin-2-one
CID 103703038
3-(azepan-3-ylamino)-1H-pyrazin-2-one
CID 114570966
3-[[(1R,2R)-2-aminocyclohexyl]amino]-1-methylpyrazin-2-one
CID 94896988
3-[(3,3-dimethylcyclohexyl)amino]-1H-pyrazin-2-one
CID 114569134
3-[(2-aminocyclopentyl)amino]-1-propylpyrazin-2-one
CID 63252226
3-(2-aminocycloheptyl)oxy-1H-pyrazin-2-one
CID 114571252
3-[(3,3-dimethylcyclopentyl)amino]-1H-pyrazin-2-one
CID 115880977
3-[(2-methylcyclohexyl)methylamino]-1H-pyrazin-2-one
CID 115657213

Frequently Asked Questions

What is the IUPAC name of 3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one?
The IUPAC name of 3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one (CID 114570941) is 3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one.
What is the SMILES notation for 3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one?
The canonical SMILES for 3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one is NC1CCCC1Nc1ncc[nH]c1=O.
What is the InChIKey of 3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one?
The InChIKey is ZBNKJJSIPCQJIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c10-6-2-1-3-7(6)13-8-9(14)12-5-4-11-8/h4-7H,1-3,10H2,(H,11,13)(H,12,14).
What are the key properties of 3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one?
3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one has a molecular weight of 194.24 g/mol, XLogP of 0.06, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-aminocyclopentyl)amino]-1H-pyrazin-2-one is sourced from PubChem (CID 114570941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).