3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide

C13H26N2O2 — CID 65169493

IUPAC3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide
SMILESCCOC1CC(NCCC(=O)NC)C1(C)CC
InChIInChI=1S/C13H26N2O2/c1-5-13(3)10(9-11(13)17-6-2)15-8-7-12(16)14-4/h10-11,15H,5-9H2,1-4H3,(H,14,16)
InChIKeyDCWQQMLOKIHQGT-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.31
Rot. Bonds7

About 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide

3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide (PubChem CID 65169493) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide.

Molecular Properties

Compound Name3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide
PubChem CID65169493
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide
SMILESCCOC1CC(NCCC(=O)NC)C1(C)CC
InChIInChI=1S/C13H26N2O2/c1-5-13(3)10(9-11(13)17-6-2)15-8-7-12(16)14-4/h10-11,15H,5-9H2,1-4H3,(H,14,16)
InChIKeyDCWQQMLOKIHQGT-UHFFFAOYSA-N
XLogP1.31
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide?
The IUPAC name of 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide (CID 65169493) is 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide.
What is the SMILES notation for 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide?
The canonical SMILES for 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide is CCOC1CC(NCCC(=O)NC)C1(C)CC.
What is the InChIKey of 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide?
The InChIKey is DCWQQMLOKIHQGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-5-13(3)10(9-11(13)17-6-2)15-8-7-12(16)14-4/h10-11,15H,5-9H2,1-4H3,(H,14,16).
What are the key properties of 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide?
3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide has a molecular weight of 242.36 g/mol, XLogP of 1.31, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-N-methylpropanamide is sourced from PubChem (CID 65169493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).