2-(pyrrolidin-2-ylmethylamino)oxyacetamide

C7H15N3O2 — CID 106639193

IUPAC2-(pyrrolidin-2-ylmethylamino)oxyacetamide
SMILESNC(=O)CONCC1CCCN1
InChIInChI=1S/C7H15N3O2/c8-7(11)5-12-10-4-6-2-1-3-9-6/h6,9-10H,1-5H2,(H2,8,11)
InChIKeyONTJMTJCDZLFGV-UHFFFAOYSA-N
MW173.22 g/mol
LogP-1.26
Rot. Bonds5

About 2-(pyrrolidin-2-ylmethylamino)oxyacetamide

2-(pyrrolidin-2-ylmethylamino)oxyacetamide (PubChem CID 106639193) has the molecular formula C7H15N3O2 and a molecular weight of 173.22 g/mol. Its IUPAC name is 2-(pyrrolidin-2-ylmethylamino)oxyacetamide.

Molecular Properties

Compound Name2-(pyrrolidin-2-ylmethylamino)oxyacetamide
PubChem CID106639193
Molecular FormulaC7H15N3O2
Molecular Weight173.22 g/mol
Exact Mass173.12
IUPAC Name2-(pyrrolidin-2-ylmethylamino)oxyacetamide
SMILESNC(=O)CONCC1CCCN1
InChIInChI=1S/C7H15N3O2/c8-7(11)5-12-10-4-6-2-1-3-9-6/h6,9-10H,1-5H2,(H2,8,11)
InChIKeyONTJMTJCDZLFGV-UHFFFAOYSA-N
XLogP-1.26
TPSA76.38 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 5-1.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(cyclohexylmethylamino)oxyacetamide
CID 112672783
(2S)-N-(2-amino-2-oxoethoxy)pyrrolidine-2-carboxamide
CID 103955972
2-chloro-N-(pyrrolidin-2-ylmethyl)acetamide
CID 71302527
[(2S)-pyrrolidin-2-yl]methyl carbamate;hydrochloride
CID 139649266
pyrrolidin-2-ylmethyl carbonochloridate
CID 175149666
3-amino-N-(pyrrolidin-2-ylmethyl)cyclohexane-1-carboxamide
CID 122080350
N-[[(2S)-pyrrolidin-2-yl]methyl]hydroxylamine
CID 91407987
N-(pyrrolidin-2-ylmethyl)but-2-ynamide
CID 107990230
[4-(pyrrolidin-2-ylmethylamino)phenyl]urea
CID 106637716
2-propan-2-yloxy-N-(pyrrolidin-2-ylmethyl)acetamide
CID 112701289
3-(piperidin-2-ylmethylamino)butanamide
CID 106634453
2-[2-(2-piperidin-2-ylethylsulfonylamino)ethoxy]acetamide
CID 106237551

Frequently Asked Questions

What is the IUPAC name of 2-(pyrrolidin-2-ylmethylamino)oxyacetamide?
The IUPAC name of 2-(pyrrolidin-2-ylmethylamino)oxyacetamide (CID 106639193) is 2-(pyrrolidin-2-ylmethylamino)oxyacetamide.
What is the SMILES notation for 2-(pyrrolidin-2-ylmethylamino)oxyacetamide?
The canonical SMILES for 2-(pyrrolidin-2-ylmethylamino)oxyacetamide is NC(=O)CONCC1CCCN1.
What is the InChIKey of 2-(pyrrolidin-2-ylmethylamino)oxyacetamide?
The InChIKey is ONTJMTJCDZLFGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O2/c8-7(11)5-12-10-4-6-2-1-3-9-6/h6,9-10H,1-5H2,(H2,8,11).
What are the key properties of 2-(pyrrolidin-2-ylmethylamino)oxyacetamide?
2-(pyrrolidin-2-ylmethylamino)oxyacetamide has a molecular weight of 173.22 g/mol, XLogP of -1.26, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyrrolidin-2-ylmethylamino)oxyacetamide is sourced from PubChem (CID 106639193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).