3-(1,3,5-triazin-2-yl)propan-1-ol

C6H9N3O — CID 57445386

IUPAC3-(1,3,5-triazin-2-yl)propan-1-ol
SMILESOCCCc1ncncn1
InChIInChI=1S/C6H9N3O/c10-3-1-2-6-8-4-7-5-9-6/h4-5,10H,1-3H2
InChIKeyIIZOVZNAVOSESJ-UHFFFAOYSA-N
MW139.16 g/mol
LogP-0.20
Rot. Bonds3

About 3-(1,3,5-triazin-2-yl)propan-1-ol

3-(1,3,5-triazin-2-yl)propan-1-ol (PubChem CID 57445386) has the molecular formula C6H9N3O and a molecular weight of 139.16 g/mol. Its IUPAC name is 3-(1,3,5-triazin-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-(1,3,5-triazin-2-yl)propan-1-ol
PubChem CID57445386
Molecular FormulaC6H9N3O
Molecular Weight139.16 g/mol
Exact Mass139.07
IUPAC Name3-(1,3,5-triazin-2-yl)propan-1-ol
SMILESOCCCc1ncncn1
InChIInChI=1S/C6H9N3O/c10-3-1-2-6-8-4-7-5-9-6/h4-5,10H,1-3H2
InChIKeyIIZOVZNAVOSESJ-UHFFFAOYSA-N
XLogP-0.20
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.16
LogP ≤ 5-0.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(1,3,5-triazin-2-yl)propan-1-ol?
The IUPAC name of 3-(1,3,5-triazin-2-yl)propan-1-ol (CID 57445386) is 3-(1,3,5-triazin-2-yl)propan-1-ol.
What is the SMILES notation for 3-(1,3,5-triazin-2-yl)propan-1-ol?
The canonical SMILES for 3-(1,3,5-triazin-2-yl)propan-1-ol is OCCCc1ncncn1.
What is the InChIKey of 3-(1,3,5-triazin-2-yl)propan-1-ol?
The InChIKey is IIZOVZNAVOSESJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O/c10-3-1-2-6-8-4-7-5-9-6/h4-5,10H,1-3H2.
What are the key properties of 3-(1,3,5-triazin-2-yl)propan-1-ol?
3-(1,3,5-triazin-2-yl)propan-1-ol has a molecular weight of 139.16 g/mol, XLogP of -0.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3,5-triazin-2-yl)propan-1-ol is sourced from PubChem (CID 57445386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).