N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide

C88H162N6O12 — CID 159487309

IUPACN-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide
SMILESC=C(C)CC(OCC1CC1)C(=O)NC(C)(C)C.CC(C)(C)CC(OCC1CC1)C(=O)NC(C)(C)C.CC(C)(C)CC(OCC1CC1)C(=O)NC(C)(C)C.CC(C)(C)NC(=O)C(CC1CC1)OCC1CC1.CC(C)(C)NC(=O)C(CC1CCC1)OCC1CC1.CC1CC1CC(OCC1CC1)C(=O)NC(C)(C)C
InChIInChI=1S/2C15H27NO2.2C15H29NO2.2C14H25NO2/c1-10-7-12(10)8-13(18-9-11-5-6-11)14(17)16-15(2,3)4;1-15(2,3)16-14(17)13(9-11-5-4-6-11)18-10-12-7-8-12;2*1-14(2,3)9-12(18-10-11-7-8-11)13(17)16-15(4,5)6;1-14(2,3)15-13(16)12(8-10-4-5-10)17-9-11-6-7-11;1-10(2)8-12(17-9-11-6-7-11)13(16)15-14(3,4)5/h10-13H,5-9H2,1-4H3,(H,16,17);11-13H,4-10H2,1-3H3,(H,16,17);2*11-12H,7-10H2,1-6H3,(H,16,17);10-12H,4-9H2,1-3H3,(H,15,16);11-12H,1,6-9H2,2-5H3,(H,15,16)
InChIKeyLXSWFMVESFCDEF-UHFFFAOYSA-N
MW1496.29 g/mol
LogP17.05
Rot. Bonds34

About N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide

N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide (PubChem CID 159487309) has the molecular formula C88H162N6O12 and a molecular weight of 1496.29 g/mol. Its IUPAC name is N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide.

Molecular Properties

Compound NameN-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide
PubChem CID159487309
Molecular FormulaC88H162N6O12
Molecular Weight1496.29 g/mol
Exact Mass1495.23
IUPAC NameN-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide
SMILESC=C(C)CC(OCC1CC1)C(=O)NC(C)(C)C.CC(C)(C)CC(OCC1CC1)C(=O)NC(C)(C)C.CC(C)(C)CC(OCC1CC1)C(=O)NC(C)(C)C.CC(C)(C)NC(=O)C(CC1CC1)OCC1CC1.CC(C)(C)NC(=O)C(CC1CCC1)OCC1CC1.CC1CC1CC(OCC1CC1)C(=O)NC(C)(C)C
InChIInChI=1S/2C15H27NO2.2C15H29NO2.2C14H25NO2/c1-10-7-12(10)8-13(18-9-11-5-6-11)14(17)16-15(2,3)4;1-15(2,3)16-14(17)13(9-11-5-4-6-11)18-10-12-7-8-12;2*1-14(2,3)9-12(18-10-11-7-8-11)13(17)16-15(4,5)6;1-14(2,3)15-13(16)12(8-10-4-5-10)17-9-11-6-7-11;1-10(2)8-12(17-9-11-6-7-11)13(16)15-14(3,4)5/h10-13H,5-9H2,1-4H3,(H,16,17);11-13H,4-10H2,1-3H3,(H,16,17);2*11-12H,7-10H2,1-6H3,(H,16,17);10-12H,4-9H2,1-3H3,(H,15,16);11-12H,1,6-9H2,2-5H3,(H,15,16)
InChIKeyLXSWFMVESFCDEF-UHFFFAOYSA-N
XLogP17.05
TPSA229.98 Ų
H-Bond Donors6
H-Bond Acceptors12
Rotatable Bonds34
Heavy Atoms106
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001496.29
LogP ≤ 517.05
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

Analyze N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide?
The IUPAC name of N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide (CID 159487309) is N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide.
What is the SMILES notation for N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide?
The canonical SMILES for N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide is C=C(C)CC(OCC1CC1)C(=O)NC(C)(C)C.CC(C)(C)CC(OCC1CC1)C(=O)NC(C)(C)C.CC(C)(C)CC(OCC1CC1)C(=O)NC(C)(C)C.CC(C)(C)NC(=O)C(CC1CC1)OCC1CC1.CC(C)(C)NC(=O)C(CC1CCC1)OCC1CC1.CC1CC1CC(OCC1CC1)C(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide?
The InChIKey is LXSWFMVESFCDEF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H27NO2.2C15H29NO2.2C14H25NO2/c1-10-7-12(10)8-13(18-9-11-5-6-11)14(17)16-15(2,3)4;1-15(2,3)16-14(17)13(9-11-5-4-6-11)18-10-12-7-8-12;2*1-14(2,3)9-12(18-10-11-7-8-11)13(17)16-15(4,5)6;1-14(2,3)15-13(16)12(8-10-4-5-10)17-9-11-6-7-11;1-10(2)8-12(17-9-11-6-7-11)13(16)15-14(3,4)5/h10-13H,5-9H2,1-4H3,(H,16,17);11-13H,4-10H2,1-3H3,(H,16,17);2*11-12H,7-10H2,1-6H3,(H,16,17);10-12H,4-9H2,1-3H3,(H,15,16);11-12H,1,6-9H2,2-5H3,(H,15,16).
What are the key properties of N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide?
N-tert-butyl-3-cyclobutyl-2-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide has a molecular weight of 1496.29 g/mol, XLogP of 17.05, 34 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-(cyclopropylmethoxy)propanamide;N-tert-butyl-3-cyclopropyl-2-(cyclopropylmethoxy)propanamide;bis(N-tert-butyl-2-(cyclopropylmethoxy)-4,4-dimethylpentanamide);N-tert-butyl-2-(cyclopropylmethoxy)-3-(2-methylcyclopropyl)propanamide;N-tert-butyl-2-(cyclopropylmethoxy)-4-methylpent-4-enamide is sourced from PubChem (CID 159487309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).