2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol

C10H12N4O — CID 84672357

IUPAC2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol
SMILESCC(N)C(O)c1cnc2ccncc2n1
InChIInChI=1S/C10H12N4O/c1-6(11)10(15)9-5-13-7-2-3-12-4-8(7)14-9/h2-6,10,15H,11H2,1H3
InChIKeyFPQNODNQTNTNOI-UHFFFAOYSA-N
MW204.23 g/mol
LogP0.41
Rot. Bonds2

About 2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol

2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol (PubChem CID 84672357) has the molecular formula C10H12N4O and a molecular weight of 204.23 g/mol. Its IUPAC name is 2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol.

Molecular Properties

Compound Name2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol
PubChem CID84672357
Molecular FormulaC10H12N4O
Molecular Weight204.23 g/mol
Exact Mass204.10
IUPAC Name2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol
SMILESCC(N)C(O)c1cnc2ccncc2n1
InChIInChI=1S/C10H12N4O/c1-6(11)10(15)9-5-13-7-2-3-12-4-8(7)14-9/h2-6,10,15H,11H2,1H3
InChIKeyFPQNODNQTNTNOI-UHFFFAOYSA-N
XLogP0.41
TPSA84.92 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol?
The IUPAC name of 2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol (CID 84672357) is 2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol.
What is the SMILES notation for 2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol?
The canonical SMILES for 2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol is CC(N)C(O)c1cnc2ccncc2n1.
What is the InChIKey of 2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol?
The InChIKey is FPQNODNQTNTNOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O/c1-6(11)10(15)9-5-13-7-2-3-12-4-8(7)14-9/h2-6,10,15H,11H2,1H3.
What are the key properties of 2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol?
2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol has a molecular weight of 204.23 g/mol, XLogP of 0.41, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-pyrido[3,4-b]pyrazin-3-ylpropan-1-ol is sourced from PubChem (CID 84672357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).