2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate

C108H152N4O10 — CID 158356979

About 2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate

2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate (PubChem CID 158356979) has the molecular formula C108H152N4O10 and a molecular weight of 1666.42 g/mol. Its IUPAC name is 2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate.

Molecular Properties

• Compound Name: 2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate
• PubChem CID: 158356979
• Molecular Formula: C108H152N4O10
• Molecular Weight: 1666.42 g/mol
• Exact Mass: 1665.15
• IUPAC Name: 2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate
• SMILES: C=C(C)C(=O)N(C)C1CC2CC1C1C3CCC(C3)C21.C=C(C)C(=O)NC1CC2CC1C1C3CCC(C3)C21.C=C(C)C(=O)OC1CC2CC1C1C3CCC(C3)C21.C=CC(=O)N(C)C1CC2CC1C1C3CCC(C3)C21.C=CC(=O)NC1CC2CC1C1C3CCC(C3)C21.C=CC(=O)OC1C2CC3CC(C2)CC1C3.C=CC(=O)OC1CC2CC1C1C3CCC(C3)C21
• InChI: InChI=1S/C17H25NO.2C16H23NO.C16H22O2.C15H21NO.C15H20O2.C13H18O2/c1-9(2)17(19)18(3)14-8-12-7-13(14)16-11-5-4-10(6-11)15(12)16;1-8(2)16(18)17-13-7-11-6-12(13)15-10-4-3-9(5-10)14(11)15;1-3-14(18)17(2)13-8-11-7-12(13)16-10-5-4-9(6-10)15(11)16;1-8(2)16(17)18-13-7-11-6-12(13)15-10-4-3-9(5-10)14(11)15;1-2-13(17)16-12-7-10-6-11(12)15-9-4-3-8(5-9)14(10)15;1-2-13(16)17-12-7-10-6-11(12)15-9-4-3-8(5-9)14(10)15;1-2-12(14)15-13-10-4-8-3-9(6-10)7-11(13)5-8/h10-16H,1,4-8H2,2-3H3;9-15H,1,3-7H2,2H3,(H,17,18);3,9-13,15-16H,1,4-8H2,2H3;9-15H,1,3-7H2,2H3;2,8-12,14-15H,1,3-7H2,(H,16,17);2,8-12,14-15H,1,3-7H2;2,8-11,13H,1,3-7H2
• InChIKey: GSZOXJWDJOQACH-UHFFFAOYSA-N
• XLogP: 19.40
• TPSA: 177.72 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 10
• Rotatable Bonds: 14
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1666.42
LogP ≤ 5	19.40
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'cyclooctane_1', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate?

The IUPAC name of 2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate (CID 158356979) is 2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate.

What is the SMILES notation for 2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate?

The canonical SMILES for 2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate is C=C(C)C(=O)N(C)C1CC2CC1C1C3CCC(C3)C21.C=C(C)C(=O)NC1CC2CC1C1C3CCC(C3)C21.C=C(C)C(=O)OC1CC2CC1C1C3CCC(C3)C21.C=CC(=O)N(C)C1CC2CC1C1C3CCC(C3)C21.C=CC(=O)NC1CC2CC1C1C3CCC(C3)C21.C=CC(=O)OC1C2CC3CC(C2)CC1C3.C=CC(=O)OC1CC2CC1C1C3CCC(C3)C21.

What is the InChIKey of 2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate?

The InChIKey is GSZOXJWDJOQACH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO.2C16H23NO.C16H22O2.C15H21NO.C15H20O2.C13H18O2/c1-9(2)17(19)18(3)14-8-12-7-13(14)16-11-5-4-10(6-11)15(12)16;1-8(2)16(18)17-13-7-11-6-12(13)15-10-4-3-9(5-10)14(11)15;1-3-14(18)17(2)13-8-11-7-12(13)16-10-5-4-9(6-10)15(11)16;1-8(2)16(17)18-13-7-11-6-12(13)15-10-4-3-9(5-10)14(11)15;1-2-13(17)16-12-7-10-6-11(12)15-9-4-3-8(5-9)14(10)15;1-2-13(16)17-12-7-10-6-11(12)15-9-4-3-8(5-9)14(10)15;1-2-12(14)15-13-10-4-8-3-9(6-10)7-11(13)5-8/h10-16H,1,4-8H2,2-3H3;9-15H,1,3-7H2,2H3,(H,17,18);3,9-13,15-16H,1,4-8H2,2H3;9-15H,1,3-7H2,2H3;2,8-12,14-15H,1,3-7H2,(H,16,17);2,8-12,14-15H,1,3-7H2;2,8-11,13H,1,3-7H2.

What are the key properties of 2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate?

2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate has a molecular weight of 1666.42 g/mol, XLogP of 19.40, 14 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2-adamantyl prop-2-enoate;N,2-dimethyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl 2-methylprop-2-enoate;N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide;4-tetracyclo[6.2.1.13,6.02,7]dodecanyl prop-2-enoate is sourced from PubChem (CID 158356979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).