N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide

C10H20N2O5 — CID 108506395

IUPACN'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide
SMILESCOCCCNC(=O)C(=O)NCCOCCO
InChIInChI=1S/C10H20N2O5/c1-16-6-2-3-11-9(14)10(15)12-4-7-17-8-5-13/h13H,2-8H2,1H3,(H,11,14)(H,12,15)
InChIKeyQAGWTVDQQPWLLL-UHFFFAOYSA-N
MW248.28 g/mol
LogP-1.74
Rot. Bonds9

About N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide

N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide (PubChem CID 108506395) has the molecular formula C10H20N2O5 and a molecular weight of 248.28 g/mol. Its IUPAC name is N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide.

Molecular Properties

Compound NameN'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide
PubChem CID108506395
Molecular FormulaC10H20N2O5
Molecular Weight248.28 g/mol
Exact Mass248.14
IUPAC NameN'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide
SMILESCOCCCNC(=O)C(=O)NCCOCCO
InChIInChI=1S/C10H20N2O5/c1-16-6-2-3-11-9(14)10(15)12-4-7-17-8-5-13/h13H,2-8H2,1H3,(H,11,14)(H,12,15)
InChIKeyQAGWTVDQQPWLLL-UHFFFAOYSA-N
XLogP-1.74
TPSA96.89 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 5-1.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[3-(2-hydroxyethoxy)propylamino]-N-(3-methoxypropyl)acetamide
CID 106309953
N,N'-bis(3-dodecoxypropyl)decanediamide;N,N'-bis[2-(2-hydroxyethoxy)ethyl]dodecanediamide;N,N'-bis[2-(2-hydroxyethoxy)ethyl]tridecanediamide;N,N'-bis(3-methoxypropyl)decanediamide;N,N'-bis(3-methoxypropyl)dodecanediamide;N,N'-bis(3-methoxypropyl)icosanediamide
CID 161275900
2-hydroxyethyl N-[2-(2-methoxyethoxy)ethyl]carbamate
CID 79348554
2-amino-N-[2-(2-hydroxyethoxy)ethyl]-4-methoxybutanamide
CID 62476612
N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]acetamide
CID 87190698
2-amino-N-[2-(2-hydroxyethoxy)ethyl]-3-methoxypropanamide
CID 81089376
1-(2-butoxyethyl)-3-(3-methoxypropyl)thiourea
CID 115595506
N-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]pentanamide
CID 54534992
N-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl]pentanamide
CID 175944386
N-[3-(2-methoxyethoxy)propyl]acetamide
CID 60668585
methyl 4-[[2-[2-(2-hydroxyethoxy)ethylamino]-2-oxoacetyl]amino]benzoate
CID 108524295
1-(2-ethoxyethyl)-3-(3-methoxypropyl)thiourea
CID 115583597

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide?
The IUPAC name of N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide (CID 108506395) is N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide.
What is the SMILES notation for N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide?
The canonical SMILES for N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide is COCCCNC(=O)C(=O)NCCOCCO.
What is the InChIKey of N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide?
The InChIKey is QAGWTVDQQPWLLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O5/c1-16-6-2-3-11-9(14)10(15)12-4-7-17-8-5-13/h13H,2-8H2,1H3,(H,11,14)(H,12,15).
What are the key properties of N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide?
N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide has a molecular weight of 248.28 g/mol, XLogP of -1.74, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-hydroxyethoxy)ethyl]-N-(3-methoxypropyl)oxamide is sourced from PubChem (CID 108506395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).