N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide

C10H16N4O4 — CID 23526547

IUPACN-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide
SMILESNCONCCNC(=O)CCN1C(=O)C=CC1=O
InChIInChI=1S/C10H16N4O4/c11-7-18-13-5-4-12-8(15)3-6-14-9(16)1-2-10(14)17/h1-2,13H,3-7,11H2,(H,12,15)
InChIKeyRPHBVIOQHSDTKS-UHFFFAOYSA-N
MW256.26 g/mol
LogP-2.14
Rot. Bonds8

About N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide

N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide (PubChem CID 23526547) has the molecular formula C10H16N4O4 and a molecular weight of 256.26 g/mol. Its IUPAC name is N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide.

Molecular Properties

Compound NameN-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide
PubChem CID23526547
Molecular FormulaC10H16N4O4
Molecular Weight256.26 g/mol
Exact Mass256.12
IUPAC NameN-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide
SMILESNCONCCNC(=O)CCN1C(=O)C=CC1=O
InChIInChI=1S/C10H16N4O4/c11-7-18-13-5-4-12-8(15)3-6-14-9(16)1-2-10(14)17/h1-2,13H,3-7,11H2,(H,12,15)
InChIKeyRPHBVIOQHSDTKS-UHFFFAOYSA-N
XLogP-2.14
TPSA113.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 5-2.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethyl]carbamoyl fluoride
CID 144854244
1-[3-[2-(2-Aminoethylamino)ethylamino]propyl]pyrrole-2,5-dione
CID 91552481
3-(2,5-dioxopyrrol-1-yl)-N-[2-(methoxyamino)ethyl]propanamide
CID 20710717
3-(2,5-dioxopyrrol-1-yl)-N-[2-(methylamino)ethyl]propanamide
CID 21135495
N-[2-(aminomethylamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide
CID 21135498
N-(2-amino-2-oxoethyl)-3-(2,5-dioxopyrrol-1-yl)propanamide
CID 21299691
3-(2,5-dioxopyrrol-1-yl)-N-[2-(ethoxyamino)ethyl]propanamide
CID 23526539
3-(2,5-dioxopyrrol-1-yl)-N-[2-(hydroxyamino)ethyl]propanamide
CID 23558129
N-(2-azidoethyl)-3-(2,5-dioxopyrrol-1-yl)propanamide
CID 44155660
N-(2-Aminoethyl)-3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)propanamide
CID 51341002
N-[2-[(3-aminodithiiran-3-yl)oxyamino]ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide
CID 58932760
N-[2-(aminomethoxyamino)ethyl]-3-(2-hydroxy-5-oxo-2H-pyrrol-1-yl)propanamide
CID 58932769

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide?
The IUPAC name of N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide (CID 23526547) is N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide.
What is the SMILES notation for N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide?
The canonical SMILES for N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide is NCONCCNC(=O)CCN1C(=O)C=CC1=O.
What is the InChIKey of N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide?
The InChIKey is RPHBVIOQHSDTKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O4/c11-7-18-13-5-4-12-8(15)3-6-14-9(16)1-2-10(14)17/h1-2,13H,3-7,11H2,(H,12,15).
What are the key properties of N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide?
N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide has a molecular weight of 256.26 g/mol, XLogP of -2.14, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethoxyamino)ethyl]-3-(2,5-dioxopyrrol-1-yl)propanamide is sourced from PubChem (CID 23526547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).