2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide

C11H21NO2 — CID 17330450

IUPAC2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide
SMILESCC(NC(=O)C(C)(C)C)C1CCCO1
InChIInChI=1S/C11H21NO2/c1-8(9-6-5-7-14-9)12-10(13)11(2,3)4/h8-9H,5-7H2,1-4H3,(H,12,13)
InChIKeyNXAHTVYUPPNVSU-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.72
Rot. Bonds2

About 2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide

2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide (PubChem CID 17330450) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide
PubChem CID17330450
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide
SMILESCC(NC(=O)C(C)(C)C)C1CCCO1
InChIInChI=1S/C11H21NO2/c1-8(9-6-5-7-14-9)12-10(13)11(2,3)4/h8-9H,5-7H2,1-4H3,(H,12,13)
InChIKeyNXAHTVYUPPNVSU-UHFFFAOYSA-N
XLogP1.72
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide (CID 17330450) is 2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide is CC(NC(=O)C(C)(C)C)C1CCCO1.
What is the InChIKey of 2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide?
The InChIKey is NXAHTVYUPPNVSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-8(9-6-5-7-14-9)12-10(13)11(2,3)4/h8-9H,5-7H2,1-4H3,(H,12,13).
What are the key properties of 2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide?
2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide has a molecular weight of 199.29 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[1-(oxolan-2-yl)ethyl]propanamide is sourced from PubChem (CID 17330450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).