3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one

C16H15N5O — CID 147437860

IUPAC3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
SMILESCCN1C(=O)CNc2ncc(-c3ccc4c(n3)C=CC4)nc21
InChIInChI=1S/C16H15N5O/c1-2-21-14(22)9-18-15-16(21)20-13(8-17-15)12-7-6-10-4-3-5-11(10)19-12/h3,5-8H,2,4,9H2,1H3,(H,17,18)
InChIKeyDVQDTTIANDPIMW-UHFFFAOYSA-N
MW293.33 g/mol
LogP1.89
Rot. Bonds2

About 3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one

3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one (PubChem CID 147437860) has the molecular formula C16H15N5O and a molecular weight of 293.33 g/mol. Its IUPAC name is 3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one.

Molecular Properties

Compound Name3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
PubChem CID147437860
Molecular FormulaC16H15N5O
Molecular Weight293.33 g/mol
Exact Mass293.13
IUPAC Name3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
SMILESCCN1C(=O)CNc2ncc(-c3ccc4c(n3)C=CC4)nc21
InChIInChI=1S/C16H15N5O/c1-2-21-14(22)9-18-15-16(21)20-13(8-17-15)12-7-6-10-4-3-5-11(10)19-12/h3,5-8H,2,4,9H2,1H3,(H,17,18)
InChIKeyDVQDTTIANDPIMW-UHFFFAOYSA-N
XLogP1.89
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-ethyl-3-[2-methyl-6-(1H-1,2,4-triazol-5-yl)-3-pyridinyl]-7,8-dihydropyrazino[2,3-b]pyrazin-6-one;hydrochloride
CID 67153895
ethene;5-ethyl-3-[2-methyl-6-(1H-1,2,4-triazol-5-yl)-3-pyridinyl]-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 144947864
3-[4-(2-hydroxypropan-2-yl)phenyl]-5-[2-(oxan-4-yl)ethyl]-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 59453066
3-[6-[(1S)-1-hydroxyethyl]-3-pyridinyl]-5-[2-(oxan-4-yl)ethyl]-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 59453124
3-[6-(4H-imidazol-2-yl)-3-pyridinyl]-5-[(4-methoxycyclohexyl)methyl]-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 153181286
3-[6-(2-hydroxypropanoyl)-3-pyridinyl]-5-(4-methoxycyclohexyl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 172739416
ethane;1-ethyl-3H-pyridine-2,6-dione
CID 91431564
3-[2-(4-methyl-1,5-dihydro-1,2,4-triazol-3-yl)-3-pyridinyl]-5-[2-(oxan-4-yl)ethyl]-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 86304077
5H-cyclopenta[b]pyridine
CID 575987
1-ethyl-8-propan-2-yl-3,4-dihydroquinoxalin-2-one
CID 84623041
3-[6-(1,2-dihydrotriazol-3-yl)-2-methyl-3-pyridinyl]-5-(1-hydroxypropan-2-yl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one
CID 67380589
3-[6-(2-hydroxypropan-2-yl)-3-pyridinyl]-5-(oxan-4-yl)-7,8-dihydropyrazino[2,3-b]pyrazin-6-one;molecular hydrogen
CID 159072734

Frequently Asked Questions

What is the IUPAC name of 3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one?
The IUPAC name of 3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one (CID 147437860) is 3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one.
What is the SMILES notation for 3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one?
The canonical SMILES for 3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one is CCN1C(=O)CNc2ncc(-c3ccc4c(n3)C=CC4)nc21.
What is the InChIKey of 3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one?
The InChIKey is DVQDTTIANDPIMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O/c1-2-21-14(22)9-18-15-16(21)20-13(8-17-15)12-7-6-10-4-3-5-11(10)19-12/h3,5-8H,2,4,9H2,1H3,(H,17,18).
What are the key properties of 3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one?
3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one has a molecular weight of 293.33 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5H-cyclopenta[b]pyridin-2-yl)-5-ethyl-7,8-dihydropyrazino[2,3-b]pyrazin-6-one is sourced from PubChem (CID 147437860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).