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-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

C30H53N29O4 — CID 162235912

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-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;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-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 162235912) has the molecular formula C30H53N29O4 and a molecular weight of 883.95 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-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;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-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: 162235912
• Molecular Formula: C30H53N29O4
• Molecular Weight: 883.95 g/mol
• Exact Mass: 883.48
• 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-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.CNc1cnoc1.CNc1cnon1.CNc1conn1.CNc1ncn[nH]1.CNc1nn[nH]n1
• InChI: InChI=1S/2C4H7N3.2C4H6N2O.2C3H6N4.2C3H5N3O.C2H5N5/c1-5-4-2-6-7-3-4;1-5-4-2-3-6-7-4;1-5-4-2-6-7-3-4;1-5-4-2-3-7-6-4;1-4-3-5-2-6-7-3;1-4-3-2-5-7-6-3;1-4-3-2-7-6-5-3;1-4-3-2-5-7-6-3;1-3-2-4-6-7-5-2/h2-3,5H,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);2,4H,1H3;2H,1H3,(H,4,6);1H3,(H2,3,4,5,6,7)
• InChIKey: ZWAYZFAEHIEPOU-UHFFFAOYSA-N
• XLogP: 1.49
• TPSA: 433.13 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 28
• Rotatable Bonds: 9
• Heavy Atoms: 63
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	883.95
LogP ≤ 5	1.49
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	28

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-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;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-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 162235912) 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-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;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-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;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-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.CNc1cnoc1.CNc1cnon1.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-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 ZWAYZFAEHIEPOU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H7N3.2C4H6N2O.2C3H6N4.2C3H5N3O.C2H5N5/c1-5-4-2-6-7-3-4;1-5-4-2-3-6-7-4;1-5-4-2-6-7-3-4;1-5-4-2-3-7-6-4;1-4-3-5-2-6-7-3;1-4-3-2-5-7-6-3;1-4-3-2-7-6-5-3;1-4-3-2-5-7-6-3;1-3-2-4-6-7-5-2/h2-3,5H,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);2,4H,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-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;N-methyloxadiazol-4-amine;N-methyl-1,2-oxazol-3-amine;N-methyl-1,2-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 883.95 g/mol, XLogP of 1.49, 9 rotatable bonds, 14 hydrogen bond donors, and 28 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-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 162235912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).