5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline

C102H137N29O6S — CID 159511209

About 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline

5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline (PubChem CID 159511209) has the molecular formula C102H137N29O6S and a molecular weight of 1897.48 g/mol. Its IUPAC name is 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline.

Molecular Properties

• Compound Name: 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline
• PubChem CID: 159511209
• Molecular Formula: C102H137N29O6S
• Molecular Weight: 1897.48 g/mol
• Exact Mass: 1896.10
• IUPAC Name: 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline
• SMILES: CNC(=O)c1cccc(NC)c1.CNC(=O)c1cccc(NC)c1.CNc1cc(C(=O)N2CCCC2)cc(C)n1.CNc1cc(C(C)(C)C)on1.CNc1cc(C2CC2)nn1C.CNc1cccc(-c2ccn[nH]2)c1.CNc1cccc(-c2cscn2)c1.CNc1cccc(-c2noc(NC)n2)c1.CNc1cccc(C2N=CN=N2)c1.CNc1ccoc1.[H]/N=C(/c1cccc(NC)c1)N(C)C(C)C
• InChI: InChI=1S/C12H17N3O.C12H19N3.C10H12N4O.C10H11N3.C10H10N2S.C9H10N4.2C9H12N2O.C8H13N3.C8H14N2O.C5H7NO/c1-9-7-10(8-11(13-2)14-9)12(16)15-5-3-4-6-15;1-9(2)15(4)12(13)10-6-5-7-11(8-10)14-3;1-11-8-5-3-4-7(6-8)9-13-10(12-2)15-14-9;1-11-9-4-2-3-8(7-9)10-5-6-12-13-10;1-11-9-4-2-3-8(5-9)10-6-13-7-12-10;1-10-8-4-2-3-7(5-8)9-11-6-12-13-9;2*1-10-8-5-3-4-7(6-8)9(12)11-2;1-9-8-5-7(6-3-4-6)10-11(8)2;1-8(2,3)6-5-7(9-4)10-11-6;1-6-5-2-3-7-4-5/h7-8H,3-6H2,1-2H3,(H,13,14);5-9,13-14H,1-4H3;3-6,11H,1-2H3,(H,12,13,14);2-7,11H,1H3,(H,12,13);2-7,11H,1H3;2-6,9-10H,1H3;2*3-6,10H,1-2H3,(H,11,12);5-6,9H,3-4H2,1-2H3;5H,1-4H3,(H,9,10);2-4,6H,1H3/b;13-12-
• InChIKey: MAPXZZGXNJLUSZ-BFTINXJPSA-N
• XLogP: 19.92
• TPSA: 437.41 Ų
• H-Bond Donors: 16
• H-Bond Acceptors: 31
• Rotatable Bonds: 22
• Heavy Atoms: 138
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1897.48
LogP ≤ 5	19.92
H-Bond Donors ≤ 5	16
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline?

The IUPAC name of 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline (CID 159511209) is 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline.

What is the SMILES notation for 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline?

The canonical SMILES for 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline is CNC(=O)c1cccc(NC)c1.CNC(=O)c1cccc(NC)c1.CNc1cc(C(=O)N2CCCC2)cc(C)n1.CNc1cc(C(C)(C)C)on1.CNc1cc(C2CC2)nn1C.CNc1cccc(-c2ccn[nH]2)c1.CNc1cccc(-c2cscn2)c1.CNc1cccc(-c2noc(NC)n2)c1.CNc1cccc(C2N=CN=N2)c1.CNc1ccoc1.[H]/N=C(/c1cccc(NC)c1)N(C)C(C)C.

What is the InChIKey of 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline?

The InChIKey is MAPXZZGXNJLUSZ-BFTINXJPSA-N. The full InChI is InChI=1S/C12H17N3O.C12H19N3.C10H12N4O.C10H11N3.C10H10N2S.C9H10N4.2C9H12N2O.C8H13N3.C8H14N2O.C5H7NO/c1-9-7-10(8-11(13-2)14-9)12(16)15-5-3-4-6-15;1-9(2)15(4)12(13)10-6-5-7-11(8-10)14-3;1-11-8-5-3-4-7(6-8)9-13-10(12-2)15-14-9;1-11-9-4-2-3-8(7-9)10-5-6-12-13-10;1-11-9-4-2-3-8(5-9)10-6-13-7-12-10;1-10-8-4-2-3-7(5-8)9-11-6-12-13-9;2*1-10-8-5-3-4-7(6-8)9(12)11-2;1-9-8-5-7(6-3-4-6)10-11(8)2;1-8(2,3)6-5-7(9-4)10-11-6;1-6-5-2-3-7-4-5/h7-8H,3-6H2,1-2H3,(H,13,14);5-9,13-14H,1-4H3;3-6,11H,1-2H3,(H,12,13,14);2-7,11H,1H3,(H,12,13);2-7,11H,1H3;2-6,9-10H,1H3;2*3-6,10H,1-2H3,(H,11,12);5-6,9H,3-4H2,1-2H3;5H,1-4H3,(H,9,10);2-4,6H,1H3/b;13-12-;;;;;;;;;.

What are the key properties of 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline?

5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline has a molecular weight of 1897.48 g/mol, XLogP of 19.92, 22 rotatable bonds, 16 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N-methylfuran-3-amine;bis(N-methyl-3-(methylamino)benzamide);N-methyl-3-[3-(methylamino)phenyl]-1,2,4-oxadiazol-5-amine;N-methyl-3-(methylamino)-N-propan-2-ylbenzenecarboximidamide;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methyl-3-(1H-pyrazol-5-yl)aniline;N-methyl-3-(1,3-thiazol-4-yl)aniline;N-methyl-3-(3H-1,2,4-triazol-3-yl)aniline is sourced from PubChem (CID 159511209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).