1-(pyrazin-2-ylamino)propan-2-ol

C7H11N3O — CID 3503970

IUPAC1-(pyrazin-2-ylamino)propan-2-ol
SMILESCC(O)CNc1cnccn1
InChIInChI=1S/C7H11N3O/c1-6(11)4-10-7-5-8-2-3-9-7/h2-3,5-6,11H,4H2,1H3,(H,9,10)
InChIKeyYZIKOHNWTJXHCB-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.27
Rot. Bonds3

About 1-(pyrazin-2-ylamino)propan-2-ol

1-(pyrazin-2-ylamino)propan-2-ol (PubChem CID 3503970) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 1-(pyrazin-2-ylamino)propan-2-ol.

Molecular Properties

Compound Name1-(pyrazin-2-ylamino)propan-2-ol
PubChem CID3503970
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name1-(pyrazin-2-ylamino)propan-2-ol
SMILESCC(O)CNc1cnccn1
InChIInChI=1S/C7H11N3O/c1-6(11)4-10-7-5-8-2-3-9-7/h2-3,5-6,11H,4H2,1H3,(H,9,10)
InChIKeyYZIKOHNWTJXHCB-UHFFFAOYSA-N
XLogP0.27
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(pyrazin-2-ylamino)propan-2-ol?
The IUPAC name of 1-(pyrazin-2-ylamino)propan-2-ol (CID 3503970) is 1-(pyrazin-2-ylamino)propan-2-ol.
What is the SMILES notation for 1-(pyrazin-2-ylamino)propan-2-ol?
The canonical SMILES for 1-(pyrazin-2-ylamino)propan-2-ol is CC(O)CNc1cnccn1.
What is the InChIKey of 1-(pyrazin-2-ylamino)propan-2-ol?
The InChIKey is YZIKOHNWTJXHCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-6(11)4-10-7-5-8-2-3-9-7/h2-3,5-6,11H,4H2,1H3,(H,9,10).
What are the key properties of 1-(pyrazin-2-ylamino)propan-2-ol?
1-(pyrazin-2-ylamino)propan-2-ol has a molecular weight of 153.19 g/mol, XLogP of 0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(pyrazin-2-ylamino)propan-2-ol is sourced from PubChem (CID 3503970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).