2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide

C15H30N2O2 — CID 115641518

IUPAC2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide
SMILESCCOC1CC(NC(C)C(=O)NCC(C)C)C1(C)C
InChIInChI=1S/C15H30N2O2/c1-7-19-13-8-12(15(13,5)6)17-11(4)14(18)16-9-10(2)3/h10-13,17H,7-9H2,1-6H3,(H,16,18)
InChIKeyYVNYHAGYKYVOKX-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.94
Rot. Bonds7

About 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide

2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide (PubChem CID 115641518) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide.

Molecular Properties

Compound Name2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide
PubChem CID115641518
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide
SMILESCCOC1CC(NC(C)C(=O)NCC(C)C)C1(C)C
InChIInChI=1S/C15H30N2O2/c1-7-19-13-8-12(15(13,5)6)17-11(4)14(18)16-9-10(2)3/h10-13,17H,7-9H2,1-6H3,(H,16,18)
InChIKeyYVNYHAGYKYVOKX-UHFFFAOYSA-N
XLogP1.94
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide?
The IUPAC name of 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide (CID 115641518) is 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide.
What is the SMILES notation for 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide?
The canonical SMILES for 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide is CCOC1CC(NC(C)C(=O)NCC(C)C)C1(C)C.
What is the InChIKey of 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide?
The InChIKey is YVNYHAGYKYVOKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-7-19-13-8-12(15(13,5)6)17-11(4)14(18)16-9-10(2)3/h10-13,17H,7-9H2,1-6H3,(H,16,18).
What are the key properties of 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide?
2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide has a molecular weight of 270.42 g/mol, XLogP of 1.94, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N-(2-methylpropyl)propanamide is sourced from PubChem (CID 115641518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).