N-(3-methoxypropyl)-N'-prop-2-enyloxamide

C9H16N2O3 — CID 2272322

IUPACN-(3-methoxypropyl)-N'-prop-2-enyloxamide
SMILESC=CCNC(=O)C(=O)NCCCOC
InChIInChI=1S/C9H16N2O3/c1-3-5-10-8(12)9(13)11-6-4-7-14-2/h3H,1,4-7H2,2H3,(H,10,12)(H,11,13)
InChIKeyGLIFEXSEBWJAMM-UHFFFAOYSA-N
MW200.24 g/mol
LogP-0.56
Rot. Bonds6

About N-(3-methoxypropyl)-N'-prop-2-enyloxamide

N-(3-methoxypropyl)-N'-prop-2-enyloxamide (PubChem CID 2272322) has the molecular formula C9H16N2O3 and a molecular weight of 200.24 g/mol. Its IUPAC name is N-(3-methoxypropyl)-N'-prop-2-enyloxamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-N'-prop-2-enyloxamide
PubChem CID2272322
Molecular FormulaC9H16N2O3
Molecular Weight200.24 g/mol
Exact Mass200.12
IUPAC NameN-(3-methoxypropyl)-N'-prop-2-enyloxamide
SMILESC=CCNC(=O)C(=O)NCCCOC
InChIInChI=1S/C9H16N2O3/c1-3-5-10-8(12)9(13)11-6-4-7-14-2/h3H,1,4-7H2,2H3,(H,10,12)(H,11,13)
InChIKeyGLIFEXSEBWJAMM-UHFFFAOYSA-N
XLogP-0.56
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 5-0.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-(3-methoxypropyl)-N'-prop-2-enyloxamide 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~1~,N~2~-diallylethanediamide
CID 241033
N-(3-methoxypropyl)-2-[4-(3-methylbut-2-enyl)piperazin-1-yl]acetamide
CID 45798084
N-(3-hydroxypropyl)-N'-(prop-2-en-1-yl)ethanediamide
CID 3099196
2-[acetyl(propan-2-yl)amino]-N-prop-2-enylacetamide
CID 113158100
N-(3-ethoxypropyl)-2-(prop-2-enylamino)-N-(2,2,2-trifluoroethyl)acetamide
CID 79279417
N-(3-propan-2-yloxypropyl)-N'-prop-2-enyloxamide
CID 1557882
N-allyl-N'-[3-(dimethylamino)propyl]ethanediamide
CID 2206810
N~1~-allyl-N~2~-isopentylethanediamide
CID 21369924
2-(diethylamino)-N-prop-2-enylacetamide
CID 51050232
N,N',N'-tris(prop-2-enyl)oxamide
CID 19437518
N-[2-(dimethylamino)ethyl]-2-[methyl(prop-2-enyl)amino]acetamide
CID 21130022
2-(ethylamino)-N,N-bis(prop-2-enyl)acetamide
CID 53796586

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-N'-prop-2-enyloxamide?
The IUPAC name of N-(3-methoxypropyl)-N'-prop-2-enyloxamide (CID 2272322) is N-(3-methoxypropyl)-N'-prop-2-enyloxamide.
What is the SMILES notation for N-(3-methoxypropyl)-N'-prop-2-enyloxamide?
The canonical SMILES for N-(3-methoxypropyl)-N'-prop-2-enyloxamide is C=CCNC(=O)C(=O)NCCCOC.
What is the InChIKey of N-(3-methoxypropyl)-N'-prop-2-enyloxamide?
The InChIKey is GLIFEXSEBWJAMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3/c1-3-5-10-8(12)9(13)11-6-4-7-14-2/h3H,1,4-7H2,2H3,(H,10,12)(H,11,13).
What are the key properties of N-(3-methoxypropyl)-N'-prop-2-enyloxamide?
N-(3-methoxypropyl)-N'-prop-2-enyloxamide has a molecular weight of 200.24 g/mol, XLogP of -0.56, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-N'-prop-2-enyloxamide is sourced from PubChem (CID 2272322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).