2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide

C7H15N3O3 — CID 145222763

IUPAC2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide
SMILESNCC(=O)NOCC1C[C@@H](O)CN1
InChIInChI=1S/C7H15N3O3/c8-2-7(12)10-13-4-5-1-6(11)3-9-5/h5-6,9,11H,1-4,8H2,(H,10,12)/t5?,6-/m1/s1
InChIKeyVVTYQEQVTNIFBB-PRJDIBJQSA-N
MW189.21 g/mol
LogP-2.28
Rot. Bonds4

About 2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide

2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide (PubChem CID 145222763) has the molecular formula C7H15N3O3 and a molecular weight of 189.21 g/mol. Its IUPAC name is 2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide.

Molecular Properties

Compound Name2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide
PubChem CID145222763
Molecular FormulaC7H15N3O3
Molecular Weight189.21 g/mol
Exact Mass189.11
IUPAC Name2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide
SMILESNCC(=O)NOCC1C[C@@H](O)CN1
InChIInChI=1S/C7H15N3O3/c8-2-7(12)10-13-4-5-1-6(11)3-9-5/h5-6,9,11H,1-4,8H2,(H,10,12)/t5?,6-/m1/s1
InChIKeyVVTYQEQVTNIFBB-PRJDIBJQSA-N
XLogP-2.28
TPSA96.61 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 5-2.28
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide?
The IUPAC name of 2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide (CID 145222763) is 2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide.
What is the SMILES notation for 2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide?
The canonical SMILES for 2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide is NCC(=O)NOCC1C[C@@H](O)CN1.
What is the InChIKey of 2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide?
The InChIKey is VVTYQEQVTNIFBB-PRJDIBJQSA-N. The full InChI is InChI=1S/C7H15N3O3/c8-2-7(12)10-13-4-5-1-6(11)3-9-5/h5-6,9,11H,1-4,8H2,(H,10,12)/t5?,6-/m1/s1.
What are the key properties of 2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide?
2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide has a molecular weight of 189.21 g/mol, XLogP of -2.28, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[(4R)-4-hydroxypyrrolidin-2-yl]methoxy]acetamide is sourced from PubChem (CID 145222763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).