N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide

C80H152N6O12 — CID 159274901

About N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide

N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide (PubChem CID 159274901) has the molecular formula C80H152N6O12 and a molecular weight of 1390.13 g/mol. Its IUPAC name is N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide.

Molecular Properties

• Compound Name: N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide
• PubChem CID: 159274901
• Molecular Formula: C80H152N6O12
• Molecular Weight: 1390.13 g/mol
• Exact Mass: 1389.15
• IUPAC Name: N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide
• SMILES: C=CCOC(C(=O)NC(C)(C)C)C(C)(C)C.C=CCOC(C(=O)NC(C)(C)C)C(C)C.C=CCOC(CC(C)(C)C)C(=O)NC(C)(C)C.C=CCOC(CC1CC1C)C(=O)NC(C)(C)C.C=CCOC(CC1CCC1)C(=O)NC(C)(C)C.CCOC(CC(C)(C)C)C(=O)NC(C)(C)C
• InChI: InChI=1S/2C14H25NO2.C14H27NO2.C13H27NO2.C13H25NO2.C12H23NO2/c1-6-7-17-12(9-11-8-10(11)2)13(16)15-14(3,4)5;1-5-9-17-12(10-11-7-6-8-11)13(16)15-14(2,3)4;1-8-9-17-11(10-13(2,3)4)12(16)15-14(5,6)7;1-8-16-10(9-12(2,3)4)11(15)14-13(5,6)7;1-8-9-16-10(12(2,3)4)11(15)14-13(5,6)7;1-7-8-15-10(9(2)3)11(14)13-12(4,5)6/h6,10-12H,1,7-9H2,2-5H3,(H,15,16);5,11-12H,1,6-10H2,2-4H3,(H,15,16);8,11H,1,9-10H2,2-7H3,(H,15,16);10H,8-9H2,1-7H3,(H,14,15);8,10H,1,9H2,2-7H3,(H,14,15);7,9-10H,1,8H2,2-6H3,(H,13,14)
• InChIKey: KYEKRHORFIORPP-UHFFFAOYSA-N
• XLogP: 15.48
• TPSA: 229.98 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 12
• Rotatable Bonds: 30
• Heavy Atoms: 98
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1390.13
LogP ≤ 5	15.48
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide?

The IUPAC name of N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide (CID 159274901) is N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide.

What is the SMILES notation for N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide?

The canonical SMILES for N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide is C=CCOC(C(=O)NC(C)(C)C)C(C)(C)C.C=CCOC(C(=O)NC(C)(C)C)C(C)C.C=CCOC(CC(C)(C)C)C(=O)NC(C)(C)C.C=CCOC(CC1CC1C)C(=O)NC(C)(C)C.C=CCOC(CC1CCC1)C(=O)NC(C)(C)C.CCOC(CC(C)(C)C)C(=O)NC(C)(C)C.

What is the InChIKey of N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide?

The InChIKey is KYEKRHORFIORPP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H25NO2.C14H27NO2.C13H27NO2.C13H25NO2.C12H23NO2/c1-6-7-17-12(9-11-8-10(11)2)13(16)15-14(3,4)5;1-5-9-17-12(10-11-7-6-8-11)13(16)15-14(2,3)4;1-8-9-17-11(10-13(2,3)4)12(16)15-14(5,6)7;1-8-16-10(9-12(2,3)4)11(15)14-13(5,6)7;1-8-9-16-10(12(2,3)4)11(15)14-13(5,6)7;1-7-8-15-10(9(2)3)11(14)13-12(4,5)6/h6,10-12H,1,7-9H2,2-5H3,(H,15,16);5,11-12H,1,6-10H2,2-4H3,(H,15,16);8,11H,1,9-10H2,2-7H3,(H,15,16);10H,8-9H2,1-7H3,(H,14,15);8,10H,1,9H2,2-7H3,(H,14,15);7,9-10H,1,8H2,2-6H3,(H,13,14).

What are the key properties of N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide?

N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide has a molecular weight of 1390.13 g/mol, XLogP of 15.48, 30 rotatable bonds, 6 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N-tert-butyl-3-cyclobutyl-2-prop-2-enoxypropanamide;N-tert-butyl-3,3-dimethyl-2-prop-2-enoxybutanamide;N-tert-butyl-4,4-dimethyl-2-prop-2-enoxypentanamide;N-tert-butyl-2-ethoxy-4,4-dimethylpentanamide;N-tert-butyl-3-(2-methylcyclopropyl)-2-prop-2-enoxypropanamide;N-tert-butyl-3-methyl-2-prop-2-enoxybutanamide is sourced from PubChem (CID 159274901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).