N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide

C11H19NO3 — CID 3442073

IUPACN-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide
SMILESCC(NC(=O)C1CCCO1)C1CCCO1
InChIInChI=1S/C11H19NO3/c1-8(9-4-2-6-14-9)12-11(13)10-5-3-7-15-10/h8-10H,2-7H2,1H3,(H,12,13)
InChIKeyQHXVOYWJYHJHPH-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.85
Rot. Bonds3

About N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide

N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide (PubChem CID 3442073) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide
PubChem CID3442073
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC NameN-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide
SMILESCC(NC(=O)C1CCCO1)C1CCCO1
InChIInChI=1S/C11H19NO3/c1-8(9-4-2-6-14-9)12-11(13)10-5-3-7-15-10/h8-10H,2-7H2,1H3,(H,12,13)
InChIKeyQHXVOYWJYHJHPH-UHFFFAOYSA-N
XLogP0.85
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(Methylamino)propyl]oxolane-2-carboxamide
CID 10535559
N-(2-methylpropyl)oxolane-2-carboxamide
CID 3307864
N-cycloheptyloxolane-2-carboxamide
CID 3155142
N-cyclohexyloxolane-2-carboxamide
CID 4125021
N,N'-ethane-1,2-diylditetrahydrofuran-2-carboxamide
CID 5082695
(2R)-N-(4-fluorocyclohexyl)oxolane-2-carboxamide
CID 178637589
2-methyl-N-(oxolan-2-ylethyl)propanamide
CID 17330448
N-Propyltetrahydrofuran-2-carboxamide
CID 4054933
N-[1-(oxolan-2-yl)ethyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 53512738
N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 94866670
N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 95149815
N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 95149816

Frequently Asked Questions

What is the IUPAC name of N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide?
The IUPAC name of N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide (CID 3442073) is N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide?
The canonical SMILES for N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide is CC(NC(=O)C1CCCO1)C1CCCO1.
What is the InChIKey of N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide?
The InChIKey is QHXVOYWJYHJHPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-8(9-4-2-6-14-9)12-11(13)10-5-3-7-15-10/h8-10H,2-7H2,1H3,(H,12,13).
What are the key properties of N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide?
N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide has a molecular weight of 213.28 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(oxolan-2-yl)ethyl]oxolane-2-carboxamide is sourced from PubChem (CID 3442073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).