3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide

C87H165N7O14 — CID 158025603

IUPAC3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide
SMILESC=CCOC(C(=O)NC(C)C)C(C)(C)C.C=CCOC(C(=O)NC(C)C)C(C)C.C=CCOC(CC(C)(C)C)C(=O)NC(C)C.C=CCOC(CC1CC1C)C(=O)NC(C)C.C=CCOC(CC1CCC1)C(=O)NC(C)C.CCOC(CC(C)(C)C)C(=O)NC(C)C.CCOC(CC1CCCC1)C(=O)NC(C)C
InChIInChI=1S/C13H23NO2.C13H25NO2.C13H23NO2.C13H25NO2.C12H25NO2.C12H23NO2.C11H21NO2/c1-5-6-16-12(8-11-7-10(11)4)13(15)14-9(2)3;1-4-16-12(13(15)14-10(2)3)9-11-7-5-6-8-11;1-4-8-16-12(9-11-6-5-7-11)13(15)14-10(2)3;1-7-8-16-11(9-13(4,5)6)12(15)14-10(2)3;1-7-15-10(8-12(4,5)6)11(14)13-9(2)3;1-7-8-15-10(12(4,5)6)11(14)13-9(2)3;1-6-7-14-10(8(2)3)11(13)12-9(4)5/h5,9-12H,1,6-8H2,2-4H3,(H,14,15);10-12H,4-9H2,1-3H3,(H,14,15);4,10-12H,1,5-9H2,2-3H3,(H,14,15);7,10-11H,1,8-9H2,2-6H3,(H,14,15);9-10H,7-8H2,1-6H3,(H,13,14);7,9-10H,1,8H2,2-6H3,(H,13,14);6,8-10H,1,7H2,2-5H3,(H,12,13)
InChIKeyFGONFNWPYGJCNL-UHFFFAOYSA-N
MW1533.31 g/mol
LogP15.63
Rot. Bonds42

About 3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide

3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide (PubChem CID 158025603) has the molecular formula C87H165N7O14 and a molecular weight of 1533.31 g/mol. Its IUPAC name is 3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide.

Molecular Properties

Compound Name3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide
PubChem CID158025603
Molecular FormulaC87H165N7O14
Molecular Weight1533.31 g/mol
Exact Mass1532.24
IUPAC Name3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide
SMILESC=CCOC(C(=O)NC(C)C)C(C)(C)C.C=CCOC(C(=O)NC(C)C)C(C)C.C=CCOC(CC(C)(C)C)C(=O)NC(C)C.C=CCOC(CC1CC1C)C(=O)NC(C)C.C=CCOC(CC1CCC1)C(=O)NC(C)C.CCOC(CC(C)(C)C)C(=O)NC(C)C.CCOC(CC1CCCC1)C(=O)NC(C)C
InChIInChI=1S/C13H23NO2.C13H25NO2.C13H23NO2.C13H25NO2.C12H25NO2.C12H23NO2.C11H21NO2/c1-5-6-16-12(8-11-7-10(11)4)13(15)14-9(2)3;1-4-16-12(13(15)14-10(2)3)9-11-7-5-6-8-11;1-4-8-16-12(9-11-6-5-7-11)13(15)14-10(2)3;1-7-8-16-11(9-13(4,5)6)12(15)14-10(2)3;1-7-15-10(8-12(4,5)6)11(14)13-9(2)3;1-7-8-15-10(12(4,5)6)11(14)13-9(2)3;1-6-7-14-10(8(2)3)11(13)12-9(4)5/h5,9-12H,1,6-8H2,2-4H3,(H,14,15);10-12H,4-9H2,1-3H3,(H,14,15);4,10-12H,1,5-9H2,2-3H3,(H,14,15);7,10-11H,1,8-9H2,2-6H3,(H,14,15);9-10H,7-8H2,1-6H3,(H,13,14);7,9-10H,1,8H2,2-6H3,(H,13,14);6,8-10H,1,7H2,2-5H3,(H,12,13)
InChIKeyFGONFNWPYGJCNL-UHFFFAOYSA-N
XLogP15.63
TPSA268.31 Ų
H-Bond Donors7
H-Bond Acceptors14
Rotatable Bonds42
Heavy Atoms108
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001533.31
LogP ≤ 515.63
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

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

Analyze 3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide?
The IUPAC name of 3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide (CID 158025603) is 3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide.
What is the SMILES notation for 3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide?
The canonical SMILES for 3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide is C=CCOC(C(=O)NC(C)C)C(C)(C)C.C=CCOC(C(=O)NC(C)C)C(C)C.C=CCOC(CC(C)(C)C)C(=O)NC(C)C.C=CCOC(CC1CC1C)C(=O)NC(C)C.C=CCOC(CC1CCC1)C(=O)NC(C)C.CCOC(CC(C)(C)C)C(=O)NC(C)C.CCOC(CC1CCCC1)C(=O)NC(C)C.
What is the InChIKey of 3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide?
The InChIKey is FGONFNWPYGJCNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2.C13H25NO2.C13H23NO2.C13H25NO2.C12H25NO2.C12H23NO2.C11H21NO2/c1-5-6-16-12(8-11-7-10(11)4)13(15)14-9(2)3;1-4-16-12(13(15)14-10(2)3)9-11-7-5-6-8-11;1-4-8-16-12(9-11-6-5-7-11)13(15)14-10(2)3;1-7-8-16-11(9-13(4,5)6)12(15)14-10(2)3;1-7-15-10(8-12(4,5)6)11(14)13-9(2)3;1-7-8-15-10(12(4,5)6)11(14)13-9(2)3;1-6-7-14-10(8(2)3)11(13)12-9(4)5/h5,9-12H,1,6-8H2,2-4H3,(H,14,15);10-12H,4-9H2,1-3H3,(H,14,15);4,10-12H,1,5-9H2,2-3H3,(H,14,15);7,10-11H,1,8-9H2,2-6H3,(H,14,15);9-10H,7-8H2,1-6H3,(H,13,14);7,9-10H,1,8H2,2-6H3,(H,13,14);6,8-10H,1,7H2,2-5H3,(H,12,13).
What are the key properties of 3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide?
3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide has a molecular weight of 1533.31 g/mol, XLogP of 15.63, 42 rotatable bonds, 7 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-N-propan-2-yl-2-prop-2-enoxypropanamide;3-cyclopentyl-2-ethoxy-N-propan-2-ylpropanamide;3,3-dimethyl-N-propan-2-yl-2-prop-2-enoxybutanamide;4,4-dimethyl-N-propan-2-yl-2-prop-2-enoxypentanamide;2-ethoxy-4,4-dimethyl-N-propan-2-ylpentanamide;3-(2-methylcyclopropyl)-N-propan-2-yl-2-prop-2-enoxypropanamide;3-methyl-N-propan-2-yl-2-prop-2-enoxybutanamide is sourced from PubChem (CID 158025603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).