(2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide

C10H20N3O3+ — CID 7269550

IUPAC(2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide
SMILESC/C(=N/O)C(=O)NCCC[NH+]1CCOCC1
InChIInChI=1S/C10H19N3O3/c1-9(12-15)10(14)11-3-2-4-13-5-7-16-8-6-13/h15H,2-8H2,1H3,(H,11,14)/p+1/b12-9-
InChIKeyYONSNRDYMWILAU-XFXZXTDPSA-O
MW230.29 g/mol
LogP-1.74
Rot. Bonds5

About (2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide

(2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide (PubChem CID 7269550) has the molecular formula C10H20N3O3+ and a molecular weight of 230.29 g/mol. Its IUPAC name is (2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide.

Molecular Properties

Compound Name(2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide
PubChem CID7269550
Molecular FormulaC10H20N3O3+
Molecular Weight230.29 g/mol
Exact Mass230.15
IUPAC Name(2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide
SMILESC/C(=N/O)C(=O)NCCC[NH+]1CCOCC1
InChIInChI=1S/C10H19N3O3/c1-9(12-15)10(14)11-3-2-4-13-5-7-16-8-6-13/h15H,2-8H2,1H3,(H,11,14)/p+1/b12-9-
InChIKeyYONSNRDYMWILAU-XFXZXTDPSA-O
XLogP-1.74
TPSA75.36 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 5-1.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide 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 (2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide?
The IUPAC name of (2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide (CID 7269550) is (2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide.
What is the SMILES notation for (2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide?
The canonical SMILES for (2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide is C/C(=N/O)C(=O)NCCC[NH+]1CCOCC1.
What is the InChIKey of (2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide?
The InChIKey is YONSNRDYMWILAU-XFXZXTDPSA-O. The full InChI is InChI=1S/C10H19N3O3/c1-9(12-15)10(14)11-3-2-4-13-5-7-16-8-6-13/h15H,2-8H2,1H3,(H,11,14)/p+1/b12-9-.
What are the key properties of (2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide?
(2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide has a molecular weight of 230.29 g/mol, XLogP of -1.74, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-hydroxyimino-N-(3-morpholin-4-ium-4-ylpropyl)propanamide is sourced from PubChem (CID 7269550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).