4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole

C52H58Cl4N8 — CID 160970081

About 4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole

4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole (PubChem CID 160970081) has the molecular formula C52H58Cl4N8 and a molecular weight of 936.90 g/mol. Its IUPAC name is 4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole.

Molecular Properties

• Compound Name: 4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole
• PubChem CID: 160970081
• Molecular Formula: C52H58Cl4N8
• Molecular Weight: 936.90 g/mol
• Exact Mass: 934.35
• IUPAC Name: 4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole
• SMILES: C.C1=NC(C[C@@H]2CCc3ccccc3C2)=CC1.C=C1NC=C(CC2CC=CC2)N1.Clc1cccc(C(c2ccccc2)c2cnc[nH]2)c1Cl.Clc1cccc(CNC2=NCCN2)c1Cl
• InChI: InChI=1S/C16H12Cl2N2.C15H17N.C10H11Cl2N3.C10H14N2.CH4/c17-13-8-4-7-12(16(13)18)15(14-9-19-10-20-14)11-5-2-1-3-6-11;1-2-5-14-10-12(7-8-13(14)4-1)11-15-6-3-9-16-15;11-8-3-1-2-7(9(8)12)6-15-10-13-4-5-14-10;1-8-11-7-10(12-8)6-9-4-2-3-5-9;/h1-10,15H,(H,19,20);1-2,4-6,9,12H,3,7-8,10-11H2;1-3H,4-6H2,(H2,13,14,15);2-3,7,9,11-12H,1,4-6H2;1H4/t;12-;;;/m.1.../s1
• InChIKey: SYDFASQPKQIPND-RCWFDLANSA-N
• XLogP: 12.96
• TPSA: 101.52 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 7
• Rotatable Bonds: 9
• Heavy Atoms: 64
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	936.90
LogP ≤ 5	12.96
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole?

The IUPAC name of 4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole (CID 160970081) is 4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole.

What is the SMILES notation for 4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole?

The canonical SMILES for 4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole is C.C1=NC(C[C@@H]2CCc3ccccc3C2)=CC1.C=C1NC=C(CC2CC=CC2)N1.Clc1cccc(C(c2ccccc2)c2cnc[nH]2)c1Cl.Clc1cccc(CNC2=NCCN2)c1Cl.

What is the InChIKey of 4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole?

The InChIKey is SYDFASQPKQIPND-RCWFDLANSA-N. The full InChI is InChI=1S/C16H12Cl2N2.C15H17N.C10H11Cl2N3.C10H14N2.CH4/c17-13-8-4-7-12(16(13)18)15(14-9-19-10-20-14)11-5-2-1-3-6-11;1-2-5-14-10-12(7-8-13(14)4-1)11-15-6-3-9-16-15;11-8-3-1-2-7(9(8)12)6-15-10-13-4-5-14-10;1-8-11-7-10(12-8)6-9-4-2-3-5-9;/h1-10,15H,(H,19,20);1-2,4-6,9,12H,3,7-8,10-11H2;1-3H,4-6H2,(H2,13,14,15);2-3,7,9,11-12H,1,4-6H2;1H4/t;12-;;;/m.1.../s1.

What are the key properties of 4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole?

4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole has a molecular weight of 936.90 g/mol, XLogP of 12.96, 9 rotatable bonds, 5 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(cyclopent-3-en-1-ylmethyl)-2-methylidene-1,3-dihydroimidazole;N-[(2,3-dichlorophenyl)methyl]-4,5-dihydro-1H-imidazol-2-amine;5-[(2,3-dichlorophenyl)-phenylmethyl]-1H-imidazole;methane;5-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]-3H-pyrrole is sourced from PubChem (CID 160970081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).