N'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide

C13H17N3O5 — CID 108524308

IUPACN'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide
SMILESNC(=O)c1ccccc1NC(=O)C(=O)NCCOCCO
InChIInChI=1S/C13H17N3O5/c14-11(18)9-3-1-2-4-10(9)16-13(20)12(19)15-5-7-21-8-6-17/h1-4,17H,5-8H2,(H2,14,18)(H,15,19)(H,16,20)
InChIKeyYDQSDRHQRVDGCS-UHFFFAOYSA-N
MW295.30 g/mol
LogP-1.15
Rot. Bonds7

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

N'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide (PubChem CID 108524308) has the molecular formula C13H17N3O5 and a molecular weight of 295.30 g/mol. Its IUPAC name is N'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide.

Molecular Properties

Compound NameN'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide
PubChem CID108524308
Molecular FormulaC13H17N3O5
Molecular Weight295.30 g/mol
Exact Mass295.12
IUPAC NameN'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide
SMILESNC(=O)c1ccccc1NC(=O)C(=O)NCCOCCO
InChIInChI=1S/C13H17N3O5/c14-11(18)9-3-1-2-4-10(9)16-13(20)12(19)15-5-7-21-8-6-17/h1-4,17H,5-8H2,(H2,14,18)(H,15,19)(H,16,20)
InChIKeyYDQSDRHQRVDGCS-UHFFFAOYSA-N
XLogP-1.15
TPSA130.75 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.30
LogP ≤ 5-1.15
H-Bond Donors ≤ 54
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

ethyl 2-[[2-[2-(2-hydroxyethoxy)ethylamino]-2-oxoacetyl]amino]benzoate
CID 108501826
N'-(2-carbamoylphenyl)-N-(3-hydroxypropyl)oxamide
CID 108524213
N'-(2-bromophenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide
CID 108524350
N'-(4-anilinophenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide
CID 108524269
2-[[2-(2-hydroxyethylamino)-2-oxoacetyl]amino]benzoic acid
CID 4026783
methyl 2-[[2-(2-hydroxyethylamino)-2-oxoacetyl]amino]benzoate
CID 108512450
N'-(2-carbamoylphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]oxamide
CID 108506282
N'-(2-carbamoylphenyl)-N-(2-ethylphenyl)oxamide
CID 108529346
N'-(2-carbamoylphenyl)-N-(pyridin-2-ylmethyl)oxamide
CID 108518371
N'-(4-acetylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide
CID 108514776
methyl 4-[[2-[2-(2-hydroxyethoxy)ethylamino]-2-oxoacetyl]amino]benzoate
CID 108524295
2-hydrazinylbenzohydrazide;bis(2-[2-(2-hydroxyethoxy)ethoxy]ethanol)
CID 69498053

Frequently Asked Questions

What is the IUPAC name of N'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide?
The IUPAC name of N'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide (CID 108524308) is N'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide.
What is the SMILES notation for N'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide?
The canonical SMILES for N'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide is NC(=O)c1ccccc1NC(=O)C(=O)NCCOCCO.
What is the InChIKey of N'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide?
The InChIKey is YDQSDRHQRVDGCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O5/c14-11(18)9-3-1-2-4-10(9)16-13(20)12(19)15-5-7-21-8-6-17/h1-4,17H,5-8H2,(H2,14,18)(H,15,19)(H,16,20).
What are the key properties of N'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide?
N'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide has a molecular weight of 295.30 g/mol, XLogP of -1.15, 7 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-carbamoylphenyl)-N-[2-(2-hydroxyethoxy)ethyl]oxamide is sourced from PubChem (CID 108524308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).