1H-imidazole;1,3,5-triazine

C6H7N5 — CID 174481549

IUPAC1H-imidazole;1,3,5-triazine
SMILESc1c[nH]cn1.c1ncncn1
InChIInChI=1S/C3H3N3.C3H4N2/c1-4-2-6-3-5-1;1-2-5-3-4-1/h1-3H;1-3H,(H,4,5)
InChIKeyWFLQODLFEUHWIP-UHFFFAOYSA-N
MW149.16 g/mol
LogP0.28
Rot. Bonds

About 1H-imidazole;1,3,5-triazine

1H-imidazole;1,3,5-triazine (PubChem CID 174481549) has the molecular formula C6H7N5 and a molecular weight of 149.16 g/mol. Its IUPAC name is 1H-imidazole;1,3,5-triazine.

Molecular Properties

Compound Name1H-imidazole;1,3,5-triazine
PubChem CID174481549
Molecular FormulaC6H7N5
Molecular Weight149.16 g/mol
Exact Mass149.07
IUPAC Name1H-imidazole;1,3,5-triazine
SMILESc1c[nH]cn1.c1ncncn1
InChIInChI=1S/C3H3N3.C3H4N2/c1-4-2-6-3-5-1;1-2-5-3-4-1/h1-3H;1-3H,(H,4,5)
InChIKeyWFLQODLFEUHWIP-UHFFFAOYSA-N
XLogP0.28
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.16
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1H-imidazole;1,3,5-triazine?
The IUPAC name of 1H-imidazole;1,3,5-triazine (CID 174481549) is 1H-imidazole;1,3,5-triazine.
What is the SMILES notation for 1H-imidazole;1,3,5-triazine?
The canonical SMILES for 1H-imidazole;1,3,5-triazine is c1c[nH]cn1.c1ncncn1.
What is the InChIKey of 1H-imidazole;1,3,5-triazine?
The InChIKey is WFLQODLFEUHWIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3N3.C3H4N2/c1-4-2-6-3-5-1;1-2-5-3-4-1/h1-3H;1-3H,(H,4,5).
What are the key properties of 1H-imidazole;1,3,5-triazine?
1H-imidazole;1,3,5-triazine has a molecular weight of 149.16 g/mol, XLogP of 0.28, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-imidazole;1,3,5-triazine is sourced from PubChem (CID 174481549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).