3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene

C170H221ClFN25O7 — CID 158471653

About 3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene

3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene (PubChem CID 158471653) has the molecular formula C170H221ClFN25O7 and a molecular weight of 2781.26 g/mol. Its IUPAC name is 3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene.

Molecular Properties

• Compound Name: 3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene
• PubChem CID: 158471653
• Molecular Formula: C170H221ClFN25O7
• Molecular Weight: 2781.26 g/mol
• Exact Mass: 2778.74
• IUPAC Name: 3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene
• SMILES: C=C(C)C(C)C(C)C.C=C(C)C(C1=CCCC=C1)C(C)C.CC(=O)C(C)C(C)C.CC(=O)C(C)C(C)C.CC1=C(C)CCC=C1.CC1CCCCC1C.CC1CCCCC1C.CC1CCCCC1C.CCC1CCCC(C)=C1C.CCC1CCCC(C)C1CC.Cc1ccccc1-c1nnc(-c2nc3ccccc3nc2N)o1.Cc1ccccc1-c1nnc(-c2nc3ccccc3nc2N)o1.Nc1nc2ccccc2nc1-c1nnc(-c2ccccc2)o1.Nc1nc2ccccc2nc1-c1nnc(-c2ccccc2Cl)o1.Nc1nc2ccccc2nc1-c1nnc(-c2ccccc2F)o1
• InChI: InChI=1S/2C17H13N5O.C16H10ClN5O.C16H10FN5O.C16H11N5O.C13H20.C11H22.C10H18.3C8H16.C8H12.C8H16.2C7H14O/c2*1-10-6-2-3-7-11(10)16-21-22-17(23-16)14-15(18)20-13-9-5-4-8-12(13)19-14;2*17-10-6-2-1-5-9(10)15-21-22-16(23-15)13-14(18)20-12-8-4-3-7-11(12)19-13;17-14-13(18-11-8-4-5-9-12(11)19-14)16-21-20-15(22-16)10-6-2-1-3-7-10;1-10(2)13(11(3)4)12-8-6-5-7-9-12;1-4-10-8-6-7-9(3)11(10)5-2;1-4-10-7-5-6-8(2)9(10)3;4*1-7-5-3-4-6-8(7)2;1-6(2)8(5)7(3)4;2*1-5(2)6(3)7(4)8/h2*2-9H,1H3,(H2,18,20);2*1-8H,(H2,18,20);1-9H,(H2,17,19);6,8-9,11,13H,1,5,7H2,2-4H3;9-11H,4-8H2,1-3H3;10H,4-7H2,1-3H3;3*7-8H,3-6H2,1-2H3;3,5H,4,6H2,1-2H3;7-8H,1H2,2-5H3;2*5-6H,1-4H3
• InChIKey: HGKLYTOEISSFNR-UHFFFAOYSA-N
• XLogP: 45.32
• TPSA: 487.74 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 32
• Rotatable Bonds: 22
• Heavy Atoms: 204
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2781.26
LogP ≤ 5	45.32
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene?

The IUPAC name of 3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene (CID 158471653) is 3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene.

What is the SMILES notation for 3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene?

The canonical SMILES for 3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene is C=C(C)C(C)C(C)C.C=C(C)C(C1=CCCC=C1)C(C)C.CC(=O)C(C)C(C)C.CC(=O)C(C)C(C)C.CC1=C(C)CCC=C1.CC1CCCCC1C.CC1CCCCC1C.CC1CCCCC1C.CCC1CCCC(C)=C1C.CCC1CCCC(C)C1CC.Cc1ccccc1-c1nnc(-c2nc3ccccc3nc2N)o1.Cc1ccccc1-c1nnc(-c2nc3ccccc3nc2N)o1.Nc1nc2ccccc2nc1-c1nnc(-c2ccccc2)o1.Nc1nc2ccccc2nc1-c1nnc(-c2ccccc2Cl)o1.Nc1nc2ccccc2nc1-c1nnc(-c2ccccc2F)o1.

What is the InChIKey of 3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene?

The InChIKey is HGKLYTOEISSFNR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C17H13N5O.C16H10ClN5O.C16H10FN5O.C16H11N5O.C13H20.C11H22.C10H18.3C8H16.C8H12.C8H16.2C7H14O/c2*1-10-6-2-3-7-11(10)16-21-22-17(23-16)14-15(18)20-13-9-5-4-8-12(13)19-14;2*17-10-6-2-1-5-9(10)15-21-22-16(23-15)13-14(18)20-12-8-4-3-7-11(12)19-13;17-14-13(18-11-8-4-5-9-12(11)19-14)16-21-20-15(22-16)10-6-2-1-3-7-10;1-10(2)13(11(3)4)12-8-6-5-7-9-12;1-4-10-8-6-7-9(3)11(10)5-2;1-4-10-7-5-6-8(2)9(10)3;4*1-7-5-3-4-6-8(7)2;1-6(2)8(5)7(3)4;2*1-5(2)6(3)7(4)8/h2*2-9H,1H3,(H2,18,20);2*1-8H,(H2,18,20);1-9H,(H2,17,19);6,8-9,11,13H,1,5,7H2,2-4H3;9-11H,4-8H2,1-3H3;10H,4-7H2,1-3H3;3*7-8H,3-6H2,1-2H3;3,5H,4,6H2,1-2H3;7-8H,1H2,2-5H3;2*5-6H,1-4H3.

What are the key properties of 3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene?

3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene has a molecular weight of 2781.26 g/mol, XLogP of 45.32, 22 rotatable bonds, 5 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;1,2-diethyl-3-methylcyclohexane;1,2-dimethylcyclohexa-1,3-diene;tris(1,2-dimethylcyclohexane);bis(3,4-dimethylpentan-2-one);2-(2,4-dimethylpent-1-en-3-yl)cyclohexa-1,3-diene;3-ethyl-1,2-dimethylcyclohexene;3-[5-(2-fluorophenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine;bis(3-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]quinoxalin-2-amine);3-(5-phenyl-1,3,4-oxadiazol-2-yl)quinoxalin-2-amine;2,3,4-trimethylpent-1-ene is sourced from PubChem (CID 158471653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).