1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine

C145H298N48O3S — CID 160659800

About 1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine

1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine (PubChem CID 160659800) has the molecular formula C145H298N48O3S and a molecular weight of 2794.38 g/mol. Its IUPAC name is 1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine.

Molecular Properties

• Compound Name: 1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine
• PubChem CID: 160659800
• Molecular Formula: C145H298N48O3S
• Molecular Weight: 2794.38 g/mol
• Exact Mass: 2792.44
• IUPAC Name: 1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine
• SMILES: CC.CC1=NCCC1.CC1=NCCN1.CC1=NCCN1C.CC1=NCCO1.CCN.CCN.CCN.CCN.CCN.CCN.CCN.CCN.CCN.CCN1C=NCC1.CCN1CCC=N1.CCN1CCCC1.CCN1CCCCC1.CCN1CCN(C)CC1.CCN1CCN=C1N.CCN1CCOCC1.CCn1cccc1.CCn1cccn1.CCn1ccnc1.CCn1cncn1.[H]/N=C(\C)C1CC1.[H]/N=C(\C)c1ccccc1.[H]/N=C(\C)c1cccs1.[H]/N=C(\C)c1ccncc1.[H]/N=C1/N(C)CCN1CC.[H]/N=C1\CCCN1CC.[H]/N=C1\OCCN1CC.[H]N=C(C)C
• InChI: InChI=1S/C8H9N.C7H8N2.C7H16N2.C7H15N.C6H13N3.C6H12N2.C6H13NO.C6H7NS.C6H13N.C6H9N.C5H11N3.C5H10N2O.2C5H10N2.C5H8N2.C5H10N2.C5H8N2.2C5H9N.C4H7N3.C4H8N2.C4H7NO.C3H7N.9C2H7N.C2H6/c1-7(9)8-5-3-2-4-6-8;1-6(8)7-2-4-9-5-3-7;1-3-9-6-4-8(2)5-7-9;1-2-8-6-4-3-5-7-8;1-3-9-5-4-8(2)6(9)7;1-2-8-5-3-4-6(8)7;1-2-7-3-5-8-6-4-7;1-5(7)6-3-2-4-8-6;2*1-2-7-5-3-4-6-7;1-2-8-4-3-7-5(8)6;1-2-7-3-4-8-5(7)6;1-5-6-3-4-7(5)2;2*1-2-7-4-3-6-5-7;2*1-2-7-5-3-4-6-7;1-5-3-2-4-6-5;1-4(6)5-2-3-5;1-2-7-4-5-3-6-7;2*1-4-5-2-3-6-4;1-3(2)4;9*1-2-3;1-2/h2-6,9H,1H3;2-5,8H,1H3;3-7H2,1-2H3;2-7H2,1H3;7H,3-5H2,1-2H3;7H,2-5H2,1H3;2-6H2,1H3;2-4,7H,1H3;2-6H2,1H3;3-6H,2H2,1H3;2-4H2,1H3,(H2,6,7);6H,2-4H2,1H3;3-4H2,1-2H3;5H,2-4H2,1H3;3-5H,2H2,1H3;4H,2-3,5H2,1H3;3-5H,2H2,1H3;2-4H2,1H3;5-6H,2-3H2,1H3;3-4H,2H2,1H3;2-3H2,1H3,(H,5,6);2-3H2,1H3;4H,1-2H3;9*2-3H2,1H3;1-2H3/b9-7+;8-6+;;;7-6-;7-6+;;7-5+;;;;6-5-;;;;;;;6-4+
• InChIKey: RLNGKKJLAXHTCU-ZPUAQTIGSA-N
• XLogP: 19.93
• TPSA: 703.53 Ų
• H-Bond Donors: 19
• H-Bond Acceptors: 48
• Rotatable Bonds: 18
• Heavy Atoms: 197
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2794.38
LogP ≤ 5	19.93
H-Bond Donors ≤ 5	19
H-Bond Acceptors ≤ 10	48

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine?

The IUPAC name of 1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine (CID 160659800) is 1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine.

What is the SMILES notation for 1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine?

The canonical SMILES for 1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine is CC.CC1=NCCC1.CC1=NCCN1.CC1=NCCN1C.CC1=NCCO1.CCN.CCN.CCN.CCN.CCN.CCN.CCN.CCN.CCN.CCN1C=NCC1.CCN1CCC=N1.CCN1CCCC1.CCN1CCCCC1.CCN1CCN(C)CC1.CCN1CCN=C1N.CCN1CCOCC1.CCn1cccc1.CCn1cccn1.CCn1ccnc1.CCn1cncn1.[H]/N=C(\C)C1CC1.[H]/N=C(\C)c1ccccc1.[H]/N=C(\C)c1cccs1.[H]/N=C(\C)c1ccncc1.[H]/N=C1/N(C)CCN1CC.[H]/N=C1\CCCN1CC.[H]/N=C1\OCCN1CC.[H]N=C(C)C.

What is the InChIKey of 1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine?

The InChIKey is RLNGKKJLAXHTCU-ZPUAQTIGSA-N. The full InChI is InChI=1S/C8H9N.C7H8N2.C7H16N2.C7H15N.C6H13N3.C6H12N2.C6H13NO.C6H7NS.C6H13N.C6H9N.C5H11N3.C5H10N2O.2C5H10N2.C5H8N2.C5H10N2.C5H8N2.2C5H9N.C4H7N3.C4H8N2.C4H7NO.C3H7N.9C2H7N.C2H6/c1-7(9)8-5-3-2-4-6-8;1-6(8)7-2-4-9-5-3-7;1-3-9-6-4-8(2)5-7-9;1-2-8-6-4-3-5-7-8;1-3-9-5-4-8(2)6(9)7;1-2-8-5-3-4-6(8)7;1-2-7-3-5-8-6-4-7;1-5(7)6-3-2-4-8-6;2*1-2-7-5-3-4-6-7;1-2-8-4-3-7-5(8)6;1-2-7-3-4-8-5(7)6;1-5-6-3-4-7(5)2;2*1-2-7-4-3-6-5-7;2*1-2-7-5-3-4-6-7;1-5-3-2-4-6-5;1-4(6)5-2-3-5;1-2-7-4-5-3-6-7;2*1-4-5-2-3-6-4;1-3(2)4;9*1-2-3;1-2/h2-6,9H,1H3;2-5,8H,1H3;3-7H2,1-2H3;2-7H2,1H3;7H,3-5H2,1-2H3;7H,2-5H2,1H3;2-6H2,1H3;2-4,7H,1H3;2-6H2,1H3;3-6H,2H2,1H3;2-4H2,1H3,(H2,6,7);6H,2-4H2,1H3;3-4H2,1-2H3;5H,2-4H2,1H3;3-5H,2H2,1H3;4H,2-3,5H2,1H3;3-5H,2H2,1H3;2-4H2,1H3;5-6H,2-3H2,1H3;3-4H,2H2,1H3;2-3H2,1H3,(H,5,6);2-3H2,1H3;4H,1-2H3;9*2-3H2,1H3;1-2H3/b9-7+;8-6+;;;7-6-;7-6+;;7-5+;;;;6-5-;;;;;;;6-4+;;;;;;;;;;;;;;.

What are the key properties of 1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine?

1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine has a molecular weight of 2794.38 g/mol, XLogP of 19.93, 18 rotatable bonds, 19 hydrogen bond donors, and 48 hydrogen bond acceptors.

Where does this data come from?

All data for 1-cyclopropylethanimine;1,2-dimethyl-4,5-dihydroimidazole;ethanamine;ethane;1-ethyl-4,5-dihydroimidazol-2-amine;1-ethyl-4,5-dihydroimidazole;2-ethyl-3,4-dihydropyrazole;1-ethylimidazole;1-ethyl-3-methylimidazolidin-2-imine;1-ethyl-4-methylpiperazine;4-ethylmorpholine;3-ethyl-1,3-oxazolidin-2-imine;1-ethylpiperidine;1-ethylpyrazole;1-ethylpyrrole;1-ethylpyrrolidine;1-ethylpyrrolidin-2-imine;1-ethyl-1,2,4-triazole;2-methyl-4,5-dihydro-1H-imidazole;2-methyl-4,5-dihydro-1,3-oxazole;5-methyl-3,4-dihydro-2H-pyrrole;1-phenylethanimine;propan-2-imine;1-pyridin-4-ylethanimine;1-thiophen-2-ylethanimine is sourced from PubChem (CID 160659800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).