2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide

C10H19NO2 — CID 10511737

IUPAC2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide
SMILESCC1(CNC(=O)C(C)(C)C)COC1
InChIInChI=1S/C10H19NO2/c1-9(2,3)8(12)11-5-10(4)6-13-7-10/h5-7H2,1-4H3,(H,11,12)
InChIKeyDXBFDJMFHVCHMU-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.19
Rot. Bonds2

About 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide

2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide (PubChem CID 10511737) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide
PubChem CID10511737
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide
SMILESCC1(CNC(=O)C(C)(C)C)COC1
InChIInChI=1S/C10H19NO2/c1-9(2,3)8(12)11-5-10(4)6-13-7-10/h5-7H2,1-4H3,(H,11,12)
InChIKeyDXBFDJMFHVCHMU-UHFFFAOYSA-N
XLogP1.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.19
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-[(3-methyloxetan-3-yl)methyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide (CID 10511737) is 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide is CC1(CNC(=O)C(C)(C)C)COC1.
What is the InChIKey of 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide?
The InChIKey is DXBFDJMFHVCHMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-9(2,3)8(12)11-5-10(4)6-13-7-10/h5-7H2,1-4H3,(H,11,12).
What are the key properties of 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide?
2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]propanamide has a molecular weight of 185.27 g/mol, XLogP of 1.19, 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-[(3-methyloxetan-3-yl)methyl]propanamide is sourced from PubChem (CID 10511737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).