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

C15H30N2O2 — CID 64850555

IUPAC3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide
SMILESCCOC1CC(NCCC(=O)N(CC)CC)C1(C)C
InChIInChI=1S/C15H30N2O2/c1-6-17(7-2)14(18)9-10-16-12-11-13(19-8-3)15(12,4)5/h12-13,16H,6-11H2,1-5H3
InChIKeyJBZSDIBKDJCHTK-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.04
Rot. Bonds8

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

3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide (PubChem CID 64850555) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide.

Molecular Properties

Compound Name3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide
PubChem CID64850555
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide
SMILESCCOC1CC(NCCC(=O)N(CC)CC)C1(C)C
InChIInChI=1S/C15H30N2O2/c1-6-17(7-2)14(18)9-10-16-12-11-13(19-8-3)15(12,4)5/h12-13,16H,6-11H2,1-5H3
InChIKeyJBZSDIBKDJCHTK-UHFFFAOYSA-N
XLogP2.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide?
The IUPAC name of 3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide (CID 64850555) is 3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide.
What is the SMILES notation for 3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide?
The canonical SMILES for 3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide is CCOC1CC(NCCC(=O)N(CC)CC)C1(C)C.
What is the InChIKey of 3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide?
The InChIKey is JBZSDIBKDJCHTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-6-17(7-2)14(18)9-10-16-12-11-13(19-8-3)15(12,4)5/h12-13,16H,6-11H2,1-5H3.
What are the key properties of 3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide?
3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide has a molecular weight of 270.42 g/mol, XLogP of 2.04, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]-N,N-diethylpropanamide is sourced from PubChem (CID 64850555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).