N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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

C112H163N5O13 — CID 158672342

About N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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

N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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 158672342) has the molecular formula C112H163N5O13 and a molecular weight of 1787.56 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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: N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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: 158672342
• Molecular Formula: C112H163N5O13
• Molecular Weight: 1787.56 g/mol
• Exact Mass: 1786.22
• IUPAC Name: N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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(CC)C1CC2CCC1C2.C=C(C)C(=O)NC1CC2CCC1C2.C=C(C)C(=O)OC1CC2CC1C1C3CCC(C3)C21.C=C(C)C(=O)OC1CC2CCC1C2.C=CC(=O)N(C)C1CC2CCC1C2.C=CC(=O)NC1CC2CC1C1C3CCC(C3)C21.C=CC(=O)NC1CC2CCC1C2.C=CC(=O)OC1CC2CC1C1C3CCC(C3)C21.C=CC(=O)OC1CC2CCC1C2
• InChI: InChI=1S/C16H22O2.C15H21NO.C15H20O2.C13H21NO.2C11H17NO.C11H16O2.C10H15NO.C10H14O2/c1-8(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;1-4-14(13(15)9(2)3)12-8-10-5-6-11(12)7-10;1-7(2)11(13)12-10-6-8-3-4-9(10)5-8;1-3-11(13)12(2)10-7-8-4-5-9(10)6-8;1-7(2)11(12)13-10-6-8-3-4-9(10)5-8;1-2-10(12)11-9-6-7-3-4-8(9)5-7;1-2-10(11)12-9-6-7-3-4-8(9)5-7/h9-15H,1,3-7H2,2H3;2,8-12,14-15H,1,3-7H2,(H,16,17);2,8-12,14-15H,1,3-7H2;10-12H,2,4-8H2,1,3H3;8-10H,1,3-6H2,2H3,(H,12,13);3,8-10H,1,4-7H2,2H3;8-10H,1,3-6H2,2H3;2,7-9H,1,3-6H2,(H,11,12);2,7-9H,1,3-6H2
• InChIKey: IECHNCXLSGKIIK-UHFFFAOYSA-N
• XLogP: 20.28
• TPSA: 233.12 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 13
• Rotatable Bonds: 19
• Heavy Atoms: 130
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1787.56
LogP ≤ 5	20.28
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	13

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 N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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 N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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 158672342) is N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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 N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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 N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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(CC)C1CC2CCC1C2.C=C(C)C(=O)NC1CC2CCC1C2.C=C(C)C(=O)OC1CC2CC1C1C3CCC(C3)C21.C=C(C)C(=O)OC1CC2CCC1C2.C=CC(=O)N(C)C1CC2CCC1C2.C=CC(=O)NC1CC2CC1C1C3CCC(C3)C21.C=CC(=O)NC1CC2CCC1C2.C=CC(=O)OC1CC2CC1C1C3CCC(C3)C21.C=CC(=O)OC1CC2CCC1C2.

What is the InChIKey of N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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 IECHNCXLSGKIIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22O2.C15H21NO.C15H20O2.C13H21NO.2C11H17NO.C11H16O2.C10H15NO.C10H14O2/c1-8(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;1-4-14(13(15)9(2)3)12-8-10-5-6-11(12)7-10;1-7(2)11(13)12-10-6-8-3-4-9(10)5-8;1-3-11(13)12(2)10-7-8-4-5-9(10)6-8;1-7(2)11(12)13-10-6-8-3-4-9(10)5-8;1-2-10(12)11-9-6-7-3-4-8(9)5-7;1-2-10(11)12-9-6-7-3-4-8(9)5-7/h9-15H,1,3-7H2,2H3;2,8-12,14-15H,1,3-7H2,(H,16,17);2,8-12,14-15H,1,3-7H2;10-12H,2,4-8H2,1,3H3;8-10H,1,3-6H2,2H3,(H,12,13);3,8-10H,1,4-7H2,2H3;8-10H,1,3-6H2,2H3;2,7-9H,1,3-6H2,(H,11,12);2,7-9H,1,3-6H2.

What are the key properties of N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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?

N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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 1787.56 g/mol, XLogP of 20.28, 19 rotatable bonds, 3 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-bicyclo[2.2.1]heptanyl)-N-ethyl-2-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-N-methylprop-2-enamide;N-(2-bicyclo[2.2.1]heptanyl)-2-methylprop-2-enamide;2-bicyclo[2.2.1]heptanyl 2-methylprop-2-enoate;N-(2-bicyclo[2.2.1]heptanyl)prop-2-enamide;2-bicyclo[2.2.1]heptanyl prop-2-enoate;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 158672342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).