1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea

C19H16N6O — CID 16730528

IUPAC1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea
SMILESCCNC(=O)Nc1ccc2ncc(-c3cnc4ccccc4c3)nc2n1
InChIInChI=1S/C19H16N6O/c1-2-20-19(26)25-17-8-7-15-18(24-17)23-16(11-22-15)13-9-12-5-3-4-6-14(12)21-10-13/h3-11H,2H2,1H3,(H2,20,23,24,25,26)
InChIKeyBKIRJDSCLWWLQC-UHFFFAOYSA-N
MW344.38 g/mol
LogP3.38
Rot. Bonds3

About 1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea

1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea (PubChem CID 16730528) has the molecular formula C19H16N6O and a molecular weight of 344.38 g/mol. Its IUPAC name is 1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea.

Molecular Properties

Compound Name1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea
PubChem CID16730528
Molecular FormulaC19H16N6O
Molecular Weight344.38 g/mol
Exact Mass344.14
IUPAC Name1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea
SMILESCCNC(=O)Nc1ccc2ncc(-c3cnc4ccccc4c3)nc2n1
InChIInChI=1S/C19H16N6O/c1-2-20-19(26)25-17-8-7-15-18(24-17)23-16(11-22-15)13-9-12-5-3-4-6-14(12)21-10-13/h3-11H,2H2,1H3,(H2,20,23,24,25,26)
InChIKeyBKIRJDSCLWWLQC-UHFFFAOYSA-N
XLogP3.38
TPSA92.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.38
LogP ≤ 53.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea?
The IUPAC name of 1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea (CID 16730528) is 1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea.
What is the SMILES notation for 1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea?
The canonical SMILES for 1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea is CCNC(=O)Nc1ccc2ncc(-c3cnc4ccccc4c3)nc2n1.
What is the InChIKey of 1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea?
The InChIKey is BKIRJDSCLWWLQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N6O/c1-2-20-19(26)25-17-8-7-15-18(24-17)23-16(11-22-15)13-9-12-5-3-4-6-14(12)21-10-13/h3-11H,2H2,1H3,(H2,20,23,24,25,26).
What are the key properties of 1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea?
1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea has a molecular weight of 344.38 g/mol, XLogP of 3.38, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(3-quinolin-3-ylpyrido[2,3-b]pyrazin-6-yl)urea is sourced from PubChem (CID 16730528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).