2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine

C19H23N5 — CID 98787854

IUPAC2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine
SMILESc1cnc2nc(N3C[C@H]4CC[C@H]3C4)c(N3C[C@H]4CC[C@H]3C4)nc2c1
InChIInChI=1S/C19H23N5/c1-2-16-17(20-7-1)22-19(24-11-13-4-6-15(24)9-13)18(21-16)23-10-12-3-5-14(23)8-12/h1-2,7,12-15H,3-6,8-11H2/t12-,13-,14-,15-/m0/s1
InChIKeyWUQSQQLTZRPBHL-AJNGGQMLSA-N
MW321.43 g/mol
LogP3.00
Rot. Bonds2

About 2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine

2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine (PubChem CID 98787854) has the molecular formula C19H23N5 and a molecular weight of 321.43 g/mol. Its IUPAC name is 2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine
PubChem CID98787854
Molecular FormulaC19H23N5
Molecular Weight321.43 g/mol
Exact Mass321.20
IUPAC Name2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine
SMILESc1cnc2nc(N3C[C@H]4CC[C@H]3C4)c(N3C[C@H]4CC[C@H]3C4)nc2c1
InChIInChI=1S/C19H23N5/c1-2-16-17(20-7-1)22-19(24-11-13-4-6-15(24)9-13)18(21-16)23-10-12-3-5-14(23)8-12/h1-2,7,12-15H,3-6,8-11H2/t12-,13-,14-,15-/m0/s1
InChIKeyWUQSQQLTZRPBHL-AJNGGQMLSA-N
XLogP3.00
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine with MolForge

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Related Compounds

2-(3-fluoro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane
CID 127437089
2-[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]quinoxaline
CID 146041854
(1R,4S)-2-(4-pyrimidin-2-ylphenyl)-2-azabicyclo[2.2.1]heptane
CID 70792646
2-(2-azabicyclo[2.2.1]heptan-2-yl)-N'-hydroxypyridine-3-carboximidamide
CID 54980530
2-(6-chloro-2-pyridinyl)-2-azabicyclo[2.2.1]heptane
CID 63588413
4-(2-azabicyclo[2.2.1]heptan-2-yl)-N-methylquinazolin-2-amine
CID 80805656
propan-2-yl 2-(2-azabicyclo[2.2.1]heptan-2-yl)pyridine-3-carboxylate
CID 133468417
2,3-bis[2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]pyrido[2,3-b]pyrazine
CID 133378933
[2-(2-azabicyclo[2.2.1]heptan-2-yl)-3-fluoro-4-pyridinyl]methanamine
CID 105389495
[1-(2-azabicyclo[2.2.1]heptan-2-yl)isoquinolin-4-yl]methanol
CID 106768108
4-(2-azabicyclo[2.2.1]heptan-2-yl)-N-ethyl-5-fluoropyrimidin-2-amine
CID 80804390
2-N,3-N-bis(1-cyclopropylpiperidin-4-yl)pyrido[2,3-b]pyrazine-2,3-diamine
CID 133373343

Frequently Asked Questions

What is the IUPAC name of 2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine?
The IUPAC name of 2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine (CID 98787854) is 2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine.
What is the SMILES notation for 2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine?
The canonical SMILES for 2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine is c1cnc2nc(N3C[C@H]4CC[C@H]3C4)c(N3C[C@H]4CC[C@H]3C4)nc2c1.
What is the InChIKey of 2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine?
The InChIKey is WUQSQQLTZRPBHL-AJNGGQMLSA-N. The full InChI is InChI=1S/C19H23N5/c1-2-16-17(20-7-1)22-19(24-11-13-4-6-15(24)9-13)18(21-16)23-10-12-3-5-14(23)8-12/h1-2,7,12-15H,3-6,8-11H2/t12-,13-,14-,15-/m0/s1.
What are the key properties of 2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine?
2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine has a molecular weight of 321.43 g/mol, XLogP of 3.00, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis[(1S,4S)-2-azabicyclo[2.2.1]heptan-2-yl]pyrido[2,3-b]pyrazine is sourced from PubChem (CID 98787854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).