N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine

C77H151N17O5S — CID 158195082

About N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine

N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine (PubChem CID 158195082) has the molecular formula C77H151N17O5S and a molecular weight of 1427.24 g/mol. Its IUPAC name is N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine.

Molecular Properties

• Compound Name: N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine
• PubChem CID: 158195082
• Molecular Formula: C77H151N17O5S
• Molecular Weight: 1427.24 g/mol
• Exact Mass: 1426.18
• IUPAC Name: N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine
• SMILES: CC(C)CNCC(C)(C)N1CCOCC1.CC(C)CNCC(C)(C)O.CC(C)CNCCNC(=O)c1nccs1.CC(C)CNCCO.CC(C)CNCCc1ncco1.CC(C)CNCCn1cccn1.Cc1cc(C)n(CCNCC(C)C)n1.Cc1cccc(CCNCC(C)C)n1
• InChI: InChI=1S/C12H26N2O.C12H20N2.C11H21N3.C10H17N3OS.C9H17N3.C9H16N2O.C8H19NO.C6H15NO/c1-11(2)9-13-10-12(3,4)14-5-7-15-8-6-14;1-10(2)9-13-8-7-12-6-4-5-11(3)14-12;1-9(2)8-12-5-6-14-11(4)7-10(3)13-14;1-8(2)7-11-3-4-12-9(14)10-13-5-6-15-10;1-9(2)8-10-5-7-12-6-3-4-11-12;1-8(2)7-10-4-3-9-11-5-6-12-9;1-7(2)5-9-6-8(3,4)10;1-6(2)5-7-3-4-8/h11,13H,5-10H2,1-4H3;4-6,10,13H,7-9H2,1-3H3;7,9,12H,5-6,8H2,1-4H3;5-6,8,11H,3-4,7H2,1-2H3,(H,12,14);3-4,6,9-10H,5,7-8H2,1-2H3;5-6,8,10H,3-4,7H2,1-2H3;7,9-10H,5-6H2,1-4H3;6-8H,3-5H2,1-2H3
• InChIKey: GAFYJQKKPSNFIR-UHFFFAOYSA-N
• XLogP: 10.20
• TPSA: 265.72 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 22
• Rotatable Bonds: 39
• Heavy Atoms: 100
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1427.24
LogP ≤ 5	10.20
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine?

The IUPAC name of N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine (CID 158195082) is N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine.

What is the SMILES notation for N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine?

The canonical SMILES for N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine is CC(C)CNCC(C)(C)N1CCOCC1.CC(C)CNCC(C)(C)O.CC(C)CNCCNC(=O)c1nccs1.CC(C)CNCCO.CC(C)CNCCc1ncco1.CC(C)CNCCn1cccn1.Cc1cc(C)n(CCNCC(C)C)n1.Cc1cccc(CCNCC(C)C)n1.

What is the InChIKey of N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine?

The InChIKey is GAFYJQKKPSNFIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O.C12H20N2.C11H21N3.C10H17N3OS.C9H17N3.C9H16N2O.C8H19NO.C6H15NO/c1-11(2)9-13-10-12(3,4)14-5-7-15-8-6-14;1-10(2)9-13-8-7-12-6-4-5-11(3)14-12;1-9(2)8-12-5-6-14-11(4)7-10(3)13-14;1-8(2)7-11-3-4-12-9(14)10-13-5-6-15-10;1-9(2)8-10-5-7-12-6-3-4-11-12;1-8(2)7-10-4-3-9-11-5-6-12-9;1-7(2)5-9-6-8(3,4)10;1-6(2)5-7-3-4-8/h11,13H,5-10H2,1-4H3;4-6,10,13H,7-9H2,1-3H3;7,9,12H,5-6,8H2,1-4H3;5-6,8,11H,3-4,7H2,1-2H3,(H,12,14);3-4,6,9-10H,5,7-8H2,1-2H3;5-6,8,10H,3-4,7H2,1-2H3;7,9-10H,5-6H2,1-4H3;6-8H,3-5H2,1-2H3.

What are the key properties of N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine?

N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine has a molecular weight of 1427.24 g/mol, XLogP of 10.20, 39 rotatable bonds, 11 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-1-(2-methylpropylamino)propan-2-ol;2-methyl-N-(2-methylpropyl)-2-morpholin-4-ylpropan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)ethanol;N-[2-(2-methylpropylamino)ethyl]-1,3-thiazole-2-carboxamide;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine is sourced from PubChem (CID 158195082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).