1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol

C13H16N4O — CID 126835844

IUPAC1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol
SMILESCC(O)[C@H]1CCCN1c1ccc2nccnc2n1
InChIInChI=1S/C13H16N4O/c1-9(18)11-3-2-8-17(11)12-5-4-10-13(16-12)15-7-6-14-10/h4-7,9,11,18H,2-3,8H2,1H3/t9?,11-/m1/s1
InChIKeyMKAPBBVCPQGATQ-HCCKASOXSA-N
MW244.30 g/mol
LogP1.37
Rot. Bonds2

About 1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol

1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol (PubChem CID 126835844) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol.

Molecular Properties

Compound Name1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol
PubChem CID126835844
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol
SMILESCC(O)[C@H]1CCCN1c1ccc2nccnc2n1
InChIInChI=1S/C13H16N4O/c1-9(18)11-3-2-8-17(11)12-5-4-10-13(16-12)15-7-6-14-10/h4-7,9,11,18H,2-3,8H2,1H3/t9?,11-/m1/s1
InChIKeyMKAPBBVCPQGATQ-HCCKASOXSA-N
XLogP1.37
TPSA62.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol?
The IUPAC name of 1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol (CID 126835844) is 1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol.
What is the SMILES notation for 1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol?
The canonical SMILES for 1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol is CC(O)[C@H]1CCCN1c1ccc2nccnc2n1.
What is the InChIKey of 1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol?
The InChIKey is MKAPBBVCPQGATQ-HCCKASOXSA-N. The full InChI is InChI=1S/C13H16N4O/c1-9(18)11-3-2-8-17(11)12-5-4-10-13(16-12)15-7-6-14-10/h4-7,9,11,18H,2-3,8H2,1H3/t9?,11-/m1/s1.
What are the key properties of 1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol?
1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol has a molecular weight of 244.30 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-1-pyrido[2,3-b]pyrazin-6-ylpyrrolidin-2-yl]ethanol is sourced from PubChem (CID 126835844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).