(3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide

C8H15N3O2 — CID 43264463

IUPAC(3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide
SMILESCCN(C(=O)C/C(N)=N/O)C1CC1
InChIInChI=1S/C8H15N3O2/c1-2-11(6-3-4-6)8(12)5-7(9)10-13/h6,13H,2-5H2,1H3,(H2,9,10)
InChIKeyPSLRHNUKDQNATO-UHFFFAOYSA-N
MW185.23 g/mol
LogP0.13
Rot. Bonds4

About (3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide

(3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide (PubChem CID 43264463) has the molecular formula C8H15N3O2 and a molecular weight of 185.23 g/mol. Its IUPAC name is (3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide.

Molecular Properties

Compound Name(3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide
PubChem CID43264463
Molecular FormulaC8H15N3O2
Molecular Weight185.23 g/mol
Exact Mass185.12
IUPAC Name(3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide
SMILESCCN(C(=O)C/C(N)=N/O)C1CC1
InChIInChI=1S/C8H15N3O2/c1-2-11(6-3-4-6)8(12)5-7(9)10-13/h6,13H,2-5H2,1H3,(H2,9,10)
InChIKeyPSLRHNUKDQNATO-UHFFFAOYSA-N
XLogP0.13
TPSA78.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide 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 (3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide?
The IUPAC name of (3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide (CID 43264463) is (3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide.
What is the SMILES notation for (3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide?
The canonical SMILES for (3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide is CCN(C(=O)C/C(N)=N/O)C1CC1.
What is the InChIKey of (3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide?
The InChIKey is PSLRHNUKDQNATO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O2/c1-2-11(6-3-4-6)8(12)5-7(9)10-13/h6,13H,2-5H2,1H3,(H2,9,10).
What are the key properties of (3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide?
(3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide has a molecular weight of 185.23 g/mol, XLogP of 0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-amino-N-cyclopropyl-N-ethyl-3-hydroxyiminopropanamide is sourced from PubChem (CID 43264463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).