N,3,3-trimethyl-N-(oxetan-3-yl)butanamide

C10H19NO2 — CID 118084467

IUPACN,3,3-trimethyl-N-(oxetan-3-yl)butanamide
SMILESCN(C(=O)CC(C)(C)C)C1COC1
InChIInChI=1S/C10H19NO2/c1-10(2,3)5-9(12)11(4)8-6-13-7-8/h8H,5-7H2,1-4H3
InChIKeyDXGIRRKEWRFXQD-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.28
Rot. Bonds2

About N,3,3-trimethyl-N-(oxetan-3-yl)butanamide

N,3,3-trimethyl-N-(oxetan-3-yl)butanamide (PubChem CID 118084467) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is N,3,3-trimethyl-N-(oxetan-3-yl)butanamide.

Molecular Properties

Compound NameN,3,3-trimethyl-N-(oxetan-3-yl)butanamide
PubChem CID118084467
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameN,3,3-trimethyl-N-(oxetan-3-yl)butanamide
SMILESCN(C(=O)CC(C)(C)C)C1COC1
InChIInChI=1S/C10H19NO2/c1-10(2,3)5-9(12)11(4)8-6-13-7-8/h8H,5-7H2,1-4H3
InChIKeyDXGIRRKEWRFXQD-UHFFFAOYSA-N
XLogP1.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,3,3-trimethyl-N-(oxetan-3-yl)butanamide?
The IUPAC name of N,3,3-trimethyl-N-(oxetan-3-yl)butanamide (CID 118084467) is N,3,3-trimethyl-N-(oxetan-3-yl)butanamide.
What is the SMILES notation for N,3,3-trimethyl-N-(oxetan-3-yl)butanamide?
The canonical SMILES for N,3,3-trimethyl-N-(oxetan-3-yl)butanamide is CN(C(=O)CC(C)(C)C)C1COC1.
What is the InChIKey of N,3,3-trimethyl-N-(oxetan-3-yl)butanamide?
The InChIKey is DXGIRRKEWRFXQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-10(2,3)5-9(12)11(4)8-6-13-7-8/h8H,5-7H2,1-4H3.
What are the key properties of N,3,3-trimethyl-N-(oxetan-3-yl)butanamide?
N,3,3-trimethyl-N-(oxetan-3-yl)butanamide has a molecular weight of 185.27 g/mol, XLogP of 1.28, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,3-trimethyl-N-(oxetan-3-yl)butanamide is sourced from PubChem (CID 118084467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).