1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea

C18H18N6O — CID 143504000

IUPAC1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea
SMILESCCNC(=O)Nc1ccc2ncc(-c3ccc4c(c3)CCN4)nc2n1
InChIInChI=1S/C18H18N6O/c1-2-19-18(25)24-16-6-5-14-17(23-16)22-15(10-21-14)11-3-4-13-12(9-11)7-8-20-13/h3-6,9-10,20H,2,7-8H2,1H3,(H2,19,22,23,24,25)
InChIKeyARLZIWLTKKGQMU-UHFFFAOYSA-N
MW334.38 g/mol
LogP2.80
Rot. Bonds3

About 1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea

1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea (PubChem CID 143504000) has the molecular formula C18H18N6O and a molecular weight of 334.38 g/mol. Its IUPAC name is 1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea.

Molecular Properties

Compound Name1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea
PubChem CID143504000
Molecular FormulaC18H18N6O
Molecular Weight334.38 g/mol
Exact Mass334.15
IUPAC Name1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea
SMILESCCNC(=O)Nc1ccc2ncc(-c3ccc4c(c3)CCN4)nc2n1
InChIInChI=1S/C18H18N6O/c1-2-19-18(25)24-16-6-5-14-17(23-16)22-15(10-21-14)11-3-4-13-12(9-11)7-8-20-13/h3-6,9-10,20H,2,7-8H2,1H3,(H2,19,22,23,24,25)
InChIKeyARLZIWLTKKGQMU-UHFFFAOYSA-N
XLogP2.80
TPSA91.83 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 52.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea?
The IUPAC name of 1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea (CID 143504000) is 1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea.
What is the SMILES notation for 1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea?
The canonical SMILES for 1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea is CCNC(=O)Nc1ccc2ncc(-c3ccc4c(c3)CCN4)nc2n1.
What is the InChIKey of 1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea?
The InChIKey is ARLZIWLTKKGQMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6O/c1-2-19-18(25)24-16-6-5-14-17(23-16)22-15(10-21-14)11-3-4-13-12(9-11)7-8-20-13/h3-6,9-10,20H,2,7-8H2,1H3,(H2,19,22,23,24,25).
What are the key properties of 1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea?
1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea has a molecular weight of 334.38 g/mol, XLogP of 2.80, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2,3-dihydro-1H-indol-5-yl)pyrido[2,3-b]pyrazin-6-yl]-3-ethylurea is sourced from PubChem (CID 143504000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).