(4-methoxyiminopyrrolidin-3-yl)methanamine

C6H13N3O — CID 4189924

IUPAC(4-methoxyiminopyrrolidin-3-yl)methanamine
SMILESCON=C1CNCC1CN
InChIInChI=1S/C6H13N3O/c1-10-9-6-4-8-3-5(6)2-7/h5,8H,2-4,7H2,1H3
InChIKeyYZBFISOEIGOFAF-UHFFFAOYSA-N
MW143.19 g/mol
LogP-0.83
Rot. Bonds2

About (4-methoxyiminopyrrolidin-3-yl)methanamine

(4-methoxyiminopyrrolidin-3-yl)methanamine (PubChem CID 4189924) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is (4-methoxyiminopyrrolidin-3-yl)methanamine.

Molecular Properties

Compound Name(4-methoxyiminopyrrolidin-3-yl)methanamine
PubChem CID4189924
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC Name(4-methoxyiminopyrrolidin-3-yl)methanamine
SMILESCON=C1CNCC1CN
InChIInChI=1S/C6H13N3O/c1-10-9-6-4-8-3-5(6)2-7/h5,8H,2-4,7H2,1H3
InChIKeyYZBFISOEIGOFAF-UHFFFAOYSA-N
XLogP-0.83
TPSA59.64 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (4-methoxyiminopyrrolidin-3-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4-methoxyiminopyrrolidin-3-yl)methanamine?
The IUPAC name of (4-methoxyiminopyrrolidin-3-yl)methanamine (CID 4189924) is (4-methoxyiminopyrrolidin-3-yl)methanamine.
What is the SMILES notation for (4-methoxyiminopyrrolidin-3-yl)methanamine?
The canonical SMILES for (4-methoxyiminopyrrolidin-3-yl)methanamine is CON=C1CNCC1CN.
What is the InChIKey of (4-methoxyiminopyrrolidin-3-yl)methanamine?
The InChIKey is YZBFISOEIGOFAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O/c1-10-9-6-4-8-3-5(6)2-7/h5,8H,2-4,7H2,1H3.
What are the key properties of (4-methoxyiminopyrrolidin-3-yl)methanamine?
(4-methoxyiminopyrrolidin-3-yl)methanamine has a molecular weight of 143.19 g/mol, XLogP of -0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyiminopyrrolidin-3-yl)methanamine is sourced from PubChem (CID 4189924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).