6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine

C13H12N6 — CID 126900410

IUPAC6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine
SMILESc1cnn(C2CN(c3ccc4nccnc4n3)C2)c1
InChIInChI=1S/C13H12N6/c1-4-16-19(7-1)10-8-18(9-10)12-3-2-11-13(17-12)15-6-5-14-11/h1-7,10H,8-9H2
InChIKeyWKTWZDCCCNYOMF-UHFFFAOYSA-N
MW252.28 g/mol
LogP1.28
Rot. Bonds2

About 6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine

6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine (PubChem CID 126900410) has the molecular formula C13H12N6 and a molecular weight of 252.28 g/mol. Its IUPAC name is 6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine
PubChem CID126900410
Molecular FormulaC13H12N6
Molecular Weight252.28 g/mol
Exact Mass252.11
IUPAC Name6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine
SMILESc1cnn(C2CN(c3ccc4nccnc4n3)C2)c1
InChIInChI=1S/C13H12N6/c1-4-16-19(7-1)10-8-18(9-10)12-3-2-11-13(17-12)15-6-5-14-11/h1-7,10H,8-9H2
InChIKeyWKTWZDCCCNYOMF-UHFFFAOYSA-N
XLogP1.28
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine?
The IUPAC name of 6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine (CID 126900410) is 6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine.
What is the SMILES notation for 6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine?
The canonical SMILES for 6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine is c1cnn(C2CN(c3ccc4nccnc4n3)C2)c1.
What is the InChIKey of 6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine?
The InChIKey is WKTWZDCCCNYOMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N6/c1-4-16-19(7-1)10-8-18(9-10)12-3-2-11-13(17-12)15-6-5-14-11/h1-7,10H,8-9H2.
What are the key properties of 6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine?
6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine has a molecular weight of 252.28 g/mol, XLogP of 1.28, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-pyrazol-1-ylazetidin-1-yl)pyrido[2,3-b]pyrazine is sourced from PubChem (CID 126900410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).