N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide

C15H27NO3 — CID 71862132

IUPACN-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide
SMILESCCOC1CC(NC(=O)C2CCOC2)C1(CC)CC
InChIInChI=1S/C15H27NO3/c1-4-15(5-2)12(9-13(15)19-6-3)16-14(17)11-7-8-18-10-11/h11-13H,4-10H2,1-3H3,(H,16,17)
InChIKeyUMVKLEQAVVKNJX-UHFFFAOYSA-N
MW269.38 g/mol
LogP2.12
Rot. Bonds6

About N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide

N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide (PubChem CID 71862132) has the molecular formula C15H27NO3 and a molecular weight of 269.38 g/mol. Its IUPAC name is N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide
PubChem CID71862132
Molecular FormulaC15H27NO3
Molecular Weight269.38 g/mol
Exact Mass269.20
IUPAC NameN-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide
SMILESCCOC1CC(NC(=O)C2CCOC2)C1(CC)CC
InChIInChI=1S/C15H27NO3/c1-4-15(5-2)12(9-13(15)19-6-3)16-14(17)11-7-8-18-10-11/h11-13H,4-10H2,1-3H3,(H,16,17)
InChIKeyUMVKLEQAVVKNJX-UHFFFAOYSA-N
XLogP2.12
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.38
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide?
The IUPAC name of N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide (CID 71862132) is N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide.
What is the SMILES notation for N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide?
The canonical SMILES for N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide is CCOC1CC(NC(=O)C2CCOC2)C1(CC)CC.
What is the InChIKey of N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide?
The InChIKey is UMVKLEQAVVKNJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO3/c1-4-15(5-2)12(9-13(15)19-6-3)16-14(17)11-7-8-18-10-11/h11-13H,4-10H2,1-3H3,(H,16,17).
What are the key properties of N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide?
N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide has a molecular weight of 269.38 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxy-2,2-diethylcyclobutyl)oxolane-3-carboxamide is sourced from PubChem (CID 71862132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).