N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine

C27H46N24O5 — CID 158059281

About N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine

N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine (PubChem CID 158059281) has the molecular formula C27H46N24O5 and a molecular weight of 786.83 g/mol. Its IUPAC name is N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine.

Molecular Properties

• Compound Name: N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine
• PubChem CID: 158059281
• Molecular Formula: C27H46N24O5
• Molecular Weight: 786.83 g/mol
• Exact Mass: 786.41
• IUPAC Name: N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine
• SMILES: CNC1=CCN=N1.CNc1ccon1.CNc1cnoc1.CNc1cnon1.CNc1cocn1.CNc1conn1.CNc1ncn[nH]1.CNc1nn[nH]n1
• InChI: InChI=1S/C4H7N3.3C4H6N2O.C3H6N4.2C3H5N3O.C2H5N5/c1-5-4-2-3-6-7-4;1-5-4-2-7-3-6-4;1-5-4-2-6-7-3-4;1-5-4-2-3-7-6-4;1-4-3-5-2-6-7-3;1-4-3-2-7-6-5-3;1-4-3-2-5-7-6-3;1-3-2-4-6-7-5-2/h2,5H,3H2,1H3;2*2-3,5H,1H3;2-3H,1H3,(H,5,6);2H,1H3,(H2,4,5,6,7);2,4H,1H3;2H,1H3,(H,4,6);1H3,(H2,3,4,5,6,7)
• InChIKey: FKLIUTZBJIWTGQ-UHFFFAOYSA-N
• XLogP: 1.97
• TPSA: 372.92 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 27
• Rotatable Bonds: 8
• Heavy Atoms: 56
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	786.83
LogP ≤ 5	1.97
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine?

The IUPAC name of N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine (CID 158059281) is N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine.

What is the SMILES notation for N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine?

The canonical SMILES for N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine is CNC1=CCN=N1.CNc1ccon1.CNc1cnoc1.CNc1cnon1.CNc1cocn1.CNc1conn1.CNc1ncn[nH]1.CNc1nn[nH]n1.

What is the InChIKey of N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine?

The InChIKey is FKLIUTZBJIWTGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3.3C4H6N2O.C3H6N4.2C3H5N3O.C2H5N5/c1-5-4-2-3-6-7-4;1-5-4-2-7-3-6-4;1-5-4-2-6-7-3-4;1-5-4-2-3-7-6-4;1-4-3-5-2-6-7-3;1-4-3-2-7-6-5-3;1-4-3-2-5-7-6-3;1-3-2-4-6-7-5-2/h2,5H,3H2,1H3;2*2-3,5H,1H3;2-3H,1H3,(H,5,6);2H,1H3,(H2,4,5,6,7);2,4H,1H3;2H,1H3,(H,4,6);1H3,(H2,3,4,5,6,7).

What are the key properties of N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine?

N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine has a molecular weight of 786.83 g/mol, XLogP of 1.97, 8 rotatable bonds, 10 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for N-methyl-1,2,5-oxadiazol-3-amine;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-oxazol-4-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-3H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine is sourced from PubChem (CID 158059281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).