1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea

C16H16N6O2 — CID 16730610

IUPAC1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea
SMILESCCNC(=O)Nc1ccc2ncc(-c3ccc(OC)nc3)nc2n1
InChIInChI=1S/C16H16N6O2/c1-3-17-16(23)22-13-6-5-11-15(21-13)20-12(9-18-11)10-4-7-14(24-2)19-8-10/h4-9H,3H2,1-2H3,(H2,17,20,21,22,23)
InChIKeyRNONJZWXMUBFCB-UHFFFAOYSA-N
MW324.34 g/mol
LogP2.24
Rot. Bonds4

About 1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea

1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea (PubChem CID 16730610) has the molecular formula C16H16N6O2 and a molecular weight of 324.34 g/mol. Its IUPAC name is 1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea.

Molecular Properties

Compound Name1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea
PubChem CID16730610
Molecular FormulaC16H16N6O2
Molecular Weight324.34 g/mol
Exact Mass324.13
IUPAC Name1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea
SMILESCCNC(=O)Nc1ccc2ncc(-c3ccc(OC)nc3)nc2n1
InChIInChI=1S/C16H16N6O2/c1-3-17-16(23)22-13-6-5-11-15(21-13)20-12(9-18-11)10-4-7-14(24-2)19-8-10/h4-9H,3H2,1-2H3,(H2,17,20,21,22,23)
InChIKeyRNONJZWXMUBFCB-UHFFFAOYSA-N
XLogP2.24
TPSA101.92 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea?
The IUPAC name of 1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea (CID 16730610) is 1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea.
What is the SMILES notation for 1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea?
The canonical SMILES for 1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea is CCNC(=O)Nc1ccc2ncc(-c3ccc(OC)nc3)nc2n1.
What is the InChIKey of 1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea?
The InChIKey is RNONJZWXMUBFCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N6O2/c1-3-17-16(23)22-13-6-5-11-15(21-13)20-12(9-18-11)10-4-7-14(24-2)19-8-10/h4-9H,3H2,1-2H3,(H2,17,20,21,22,23).
What are the key properties of 1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea?
1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea has a molecular weight of 324.34 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[3-(6-methoxy-3-pyridinyl)pyrido[2,3-b]pyrazin-6-yl]urea is sourced from PubChem (CID 16730610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).