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

C33H58N32O5 — CID 158836289

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

N-methyl-1,2,5-oxadiazol-3-amine;bis(N-methyloxadiazol-4-amine);N-methyl-1,2-oxazol-3-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-1H-pyrazol-4-amine;N-methyl-1H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine;N-methyl-2H-triazol-4-amine (PubChem CID 158836289) has the molecular formula C33H58N32O5 and a molecular weight of 983.05 g/mol. Its IUPAC name is N-methyl-1,2,5-oxadiazol-3-amine;bis(N-methyloxadiazol-4-amine);N-methyl-1,2-oxazol-3-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-1H-pyrazol-4-amine;N-methyl-1H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine;N-methyl-2H-triazol-4-amine.

Molecular Properties

• Compound Name: N-methyl-1,2,5-oxadiazol-3-amine;bis(N-methyloxadiazol-4-amine);N-methyl-1,2-oxazol-3-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-1H-pyrazol-4-amine;N-methyl-1H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine;N-methyl-2H-triazol-4-amine
• PubChem CID: 158836289
• Molecular Formula: C33H58N32O5
• Molecular Weight: 983.05 g/mol
• Exact Mass: 982.53
• IUPAC Name: N-methyl-1,2,5-oxadiazol-3-amine;bis(N-methyloxadiazol-4-amine);N-methyl-1,2-oxazol-3-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-1H-pyrazol-4-amine;N-methyl-1H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine;N-methyl-2H-triazol-4-amine
• SMILES: CNc1ccn[nH]1.CNc1ccon1.CNc1cn[nH]c1.CNc1cn[nH]n1.CNc1cnon1.CNc1cocn1.CNc1conn1.CNc1conn1.CNc1ncn[nH]1.CNc1nn[nH]n1
• InChI: InChI=1S/2C4H7N3.2C4H6N2O.2C3H6N4.3C3H5N3O.C2H5N5/c1-5-4-2-6-7-3-4;1-5-4-2-3-6-7-4;1-5-4-2-7-3-6-4;1-5-4-2-3-7-6-4;1-4-3-5-2-6-7-3;1-4-3-2-5-7-6-3;2*1-4-3-2-7-6-5-3;1-4-3-2-5-7-6-3;1-3-2-4-6-7-5-2/h2-3,5H,1H3,(H,6,7);2-3H,1H3,(H2,5,6,7);2-3,5H,1H3;2-3H,1H3,(H,5,6);2*2H,1H3,(H2,4,5,6,7);2*2,4H,1H3;2H,1H3,(H,4,6);1H3,(H2,3,4,5,6,7)
• InChIKey: IXRJFWFVGOHRCX-UHFFFAOYSA-N
• XLogP: 1.60
• TPSA: 484.08 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 32
• Rotatable Bonds: 10
• Heavy Atoms: 70
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	983.05
LogP ≤ 5	1.60
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

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

The IUPAC name of N-methyl-1,2,5-oxadiazol-3-amine;bis(N-methyloxadiazol-4-amine);N-methyl-1,2-oxazol-3-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-1H-pyrazol-4-amine;N-methyl-1H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine;N-methyl-2H-triazol-4-amine (CID 158836289) is N-methyl-1,2,5-oxadiazol-3-amine;bis(N-methyloxadiazol-4-amine);N-methyl-1,2-oxazol-3-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-1H-pyrazol-4-amine;N-methyl-1H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine;N-methyl-2H-triazol-4-amine.

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

The canonical SMILES for N-methyl-1,2,5-oxadiazol-3-amine;bis(N-methyloxadiazol-4-amine);N-methyl-1,2-oxazol-3-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-1H-pyrazol-4-amine;N-methyl-1H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine;N-methyl-2H-triazol-4-amine is CNc1ccn[nH]1.CNc1ccon1.CNc1cn[nH]c1.CNc1cn[nH]n1.CNc1cnon1.CNc1cocn1.CNc1conn1.CNc1conn1.CNc1ncn[nH]1.CNc1nn[nH]n1.

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

The InChIKey is IXRJFWFVGOHRCX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H7N3.2C4H6N2O.2C3H6N4.3C3H5N3O.C2H5N5/c1-5-4-2-6-7-3-4;1-5-4-2-3-6-7-4;1-5-4-2-7-3-6-4;1-5-4-2-3-7-6-4;1-4-3-5-2-6-7-3;1-4-3-2-5-7-6-3;2*1-4-3-2-7-6-5-3;1-4-3-2-5-7-6-3;1-3-2-4-6-7-5-2/h2-3,5H,1H3,(H,6,7);2-3H,1H3,(H2,5,6,7);2-3,5H,1H3;2-3H,1H3,(H,5,6);2*2H,1H3,(H2,4,5,6,7);2*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;bis(N-methyloxadiazol-4-amine);N-methyl-1,2-oxazol-3-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-1H-pyrazol-4-amine;N-methyl-1H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine;N-methyl-2H-triazol-4-amine?

N-methyl-1,2,5-oxadiazol-3-amine;bis(N-methyloxadiazol-4-amine);N-methyl-1,2-oxazol-3-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-1H-pyrazol-4-amine;N-methyl-1H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine;N-methyl-2H-triazol-4-amine has a molecular weight of 983.05 g/mol, XLogP of 1.60, 10 rotatable bonds, 15 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for N-methyl-1,2,5-oxadiazol-3-amine;bis(N-methyloxadiazol-4-amine);N-methyl-1,2-oxazol-3-amine;N-methyl-1,3-oxazol-4-amine;N-methyl-1H-pyrazol-4-amine;N-methyl-1H-pyrazol-5-amine;N-methyl-2H-tetrazol-5-amine;N-methyl-1H-1,2,4-triazol-5-amine;N-methyl-2H-triazol-4-amine is sourced from PubChem (CID 158836289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).