N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide

C10H18N2O3 — CID 112533548

IUPACN-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC(=O)CC1(N)COC1
InChIInChI=1S/C10H18N2O3/c1-9(2,3)8(14)12-7(13)4-10(11)5-15-6-10/h4-6,11H2,1-3H3,(H,12,13,14)
InChIKeyQOMGPUQYSZHSGN-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.21
Rot. Bonds2

About N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide

N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide (PubChem CID 112533548) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide
PubChem CID112533548
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC NameN-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC(=O)CC1(N)COC1
InChIInChI=1S/C10H18N2O3/c1-9(2,3)8(14)12-7(13)4-10(11)5-15-6-10/h4-6,11H2,1-3H3,(H,12,13,14)
InChIKeyQOMGPUQYSZHSGN-UHFFFAOYSA-N
XLogP-0.21
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide (CID 112533548) is N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide is CC(C)(C)C(=O)NC(=O)CC1(N)COC1.
What is the InChIKey of N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide?
The InChIKey is QOMGPUQYSZHSGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-9(2,3)8(14)12-7(13)4-10(11)5-15-6-10/h4-6,11H2,1-3H3,(H,12,13,14).
What are the key properties of N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide?
N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide has a molecular weight of 214.26 g/mol, XLogP of -0.21, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-aminooxetan-3-yl)acetyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 112533548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).