N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine

C132H229N31O4S2 — CID 157344041

About N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine

N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine (PubChem CID 157344041) has the molecular formula C132H229N31O4S2 and a molecular weight of 2378.63 g/mol. Its IUPAC name is N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine.

Molecular Properties

• Compound Name: N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine
• PubChem CID: 157344041
• Molecular Formula: C132H229N31O4S2
• Molecular Weight: 2378.63 g/mol
• Exact Mass: 2376.81
• IUPAC Name: N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine
• SMILES: CC(C)CNCC(=O)c1ccccn1.CC(C)CNCCc1ccccn1.CC(C)CNCCc1cccnn1.CC(C)CNCCc1ccncn1.CC(C)CNCCc1cnccn1.CC(C)CNCCc1ncco1.CC(C)CNCCc1nccs1.CC(C)CNCCn1cccn1.Cc1cc(C)n(CCNCC(C)C)n1.Cc1cc(CCNCC(C)C)no1.Cc1cccc(CCNCC(C)C)n1.Cc1coc(CCNCC(C)C)n1.Cc1csc(CCNCC(C)C)n1
• InChI: InChI=1S/C12H20N2.C11H21N3.C11H16N2O.C11H18N2.3C10H17N3.2C10H18N2O.C10H18N2S.C9H17N3.C9H16N2O.C9H16N2S/c1-10(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;1-9(2)7-12-8-11(14)10-5-3-4-6-13-10;1-10(2)9-12-8-6-11-5-3-4-7-13-11;1-9(2)7-11-5-3-10-4-6-12-8-13-10;1-9(2)7-11-4-3-10-8-12-5-6-13-10;1-9(2)8-11-7-5-10-4-3-6-12-13-10;1-8(2)7-11-5-4-10-6-9(3)13-12-10;2*1-8(2)6-11-5-4-10-12-9(3)7-13-10;1-9(2)8-10-5-7-12-6-3-4-11-12;2*1-8(2)7-10-4-3-9-11-5-6-12-9/h4-6,10,13H,7-9H2,1-3H3;7,9,12H,5-6,8H2,1-4H3;3-6,9,12H,7-8H2,1-2H3;3-5,7,10,12H,6,8-9H2,1-2H3;4,6,8-9,11H,3,5,7H2,1-2H3;5-6,8-9,11H,3-4,7H2,1-2H3;3-4,6,9,11H,5,7-8H2,1-2H3;6,8,11H,4-5,7H2,1-3H3;2*7-8,11H,4-6H2,1-3H3;3-4,6,9-10H,5,7-8H2,1-2H3;2*5-6,8,10H,3-4,7H2,1-2H3
• InChIKey: BGSYLYLHEWZOBA-UHFFFAOYSA-N
• XLogP: 21.40
• TPSA: 428.98 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 37
• Rotatable Bonds: 65
• Heavy Atoms: 169
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2378.63
LogP ≤ 5	21.40
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	37

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-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine?

The IUPAC name of N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine (CID 157344041) is N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine.

What is the SMILES notation for N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine?

The canonical SMILES for N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine is CC(C)CNCC(=O)c1ccccn1.CC(C)CNCCc1ccccn1.CC(C)CNCCc1cccnn1.CC(C)CNCCc1ccncn1.CC(C)CNCCc1cnccn1.CC(C)CNCCc1ncco1.CC(C)CNCCc1nccs1.CC(C)CNCCn1cccn1.Cc1cc(C)n(CCNCC(C)C)n1.Cc1cc(CCNCC(C)C)no1.Cc1cccc(CCNCC(C)C)n1.Cc1coc(CCNCC(C)C)n1.Cc1csc(CCNCC(C)C)n1.

What is the InChIKey of N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine?

The InChIKey is BGSYLYLHEWZOBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2.C11H21N3.C11H16N2O.C11H18N2.3C10H17N3.2C10H18N2O.C10H18N2S.C9H17N3.C9H16N2O.C9H16N2S/c1-10(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;1-9(2)7-12-8-11(14)10-5-3-4-6-13-10;1-10(2)9-12-8-6-11-5-3-4-7-13-11;1-9(2)7-11-5-3-10-4-6-12-8-13-10;1-9(2)7-11-4-3-10-8-12-5-6-13-10;1-9(2)8-11-7-5-10-4-3-6-12-13-10;1-8(2)7-11-5-4-10-6-9(3)13-12-10;2*1-8(2)6-11-5-4-10-12-9(3)7-13-10;1-9(2)8-10-5-7-12-6-3-4-11-12;2*1-8(2)7-10-4-3-9-11-5-6-12-9/h4-6,10,13H,7-9H2,1-3H3;7,9,12H,5-6,8H2,1-4H3;3-6,9,12H,7-8H2,1-2H3;3-5,7,10,12H,6,8-9H2,1-2H3;4,6,8-9,11H,3,5,7H2,1-2H3;5-6,8-9,11H,3-4,7H2,1-2H3;3-4,6,9,11H,5,7-8H2,1-2H3;6,8,11H,4-5,7H2,1-3H3;2*7-8,11H,4-6H2,1-3H3;3-4,6,9-10H,5,7-8H2,1-2H3;2*5-6,8,10H,3-4,7H2,1-2H3.

What are the key properties of N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine?

N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine has a molecular weight of 2378.63 g/mol, XLogP of 21.40, 65 rotatable bonds, 13 hydrogen bond donors, and 37 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-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine is sourced from PubChem (CID 157344041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).