2-(1,3,5-triazin-2-yl)propanamide

C6H8N4O — CID 175819510

IUPAC2-(1,3,5-triazin-2-yl)propanamide
SMILESCC(C(N)=O)c1ncncn1
InChIInChI=1S/C6H8N4O/c1-4(5(7)11)6-9-2-8-3-10-6/h2-4H,1H3,(H2,7,11)
InChIKeyQYONVRYZRTVBGK-UHFFFAOYSA-N
MW152.16 g/mol
LogP-0.54
Rot. Bonds2

About 2-(1,3,5-triazin-2-yl)propanamide

2-(1,3,5-triazin-2-yl)propanamide (PubChem CID 175819510) has the molecular formula C6H8N4O and a molecular weight of 152.16 g/mol. Its IUPAC name is 2-(1,3,5-triazin-2-yl)propanamide.

Molecular Properties

Compound Name2-(1,3,5-triazin-2-yl)propanamide
PubChem CID175819510
Molecular FormulaC6H8N4O
Molecular Weight152.16 g/mol
Exact Mass152.07
IUPAC Name2-(1,3,5-triazin-2-yl)propanamide
SMILESCC(C(N)=O)c1ncncn1
InChIInChI=1S/C6H8N4O/c1-4(5(7)11)6-9-2-8-3-10-6/h2-4H,1H3,(H2,7,11)
InChIKeyQYONVRYZRTVBGK-UHFFFAOYSA-N
XLogP-0.54
TPSA81.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.16
LogP ≤ 5-0.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3,5-triazin-2-yl)propanamide?
The IUPAC name of 2-(1,3,5-triazin-2-yl)propanamide (CID 175819510) is 2-(1,3,5-triazin-2-yl)propanamide.
What is the SMILES notation for 2-(1,3,5-triazin-2-yl)propanamide?
The canonical SMILES for 2-(1,3,5-triazin-2-yl)propanamide is CC(C(N)=O)c1ncncn1.
What is the InChIKey of 2-(1,3,5-triazin-2-yl)propanamide?
The InChIKey is QYONVRYZRTVBGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O/c1-4(5(7)11)6-9-2-8-3-10-6/h2-4H,1H3,(H2,7,11).
What are the key properties of 2-(1,3,5-triazin-2-yl)propanamide?
2-(1,3,5-triazin-2-yl)propanamide has a molecular weight of 152.16 g/mol, XLogP of -0.54, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3,5-triazin-2-yl)propanamide is sourced from PubChem (CID 175819510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).