N'-cyclopentyl-N-(3-methoxypropyl)oxamide

C11H20N2O3 — CID 558387

IUPACN'-cyclopentyl-N-(3-methoxypropyl)oxamide
SMILESCOCCCNC(=O)C(=O)NC1CCCC1
InChIInChI=1S/C11H20N2O3/c1-16-8-4-7-12-10(14)11(15)13-9-5-2-3-6-9/h9H,2-8H2,1H3,(H,12,14)(H,13,15)
InChIKeyGXBNEYBUKHAYEA-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.20
Rot. Bonds5

About N'-cyclopentyl-N-(3-methoxypropyl)oxamide

N'-cyclopentyl-N-(3-methoxypropyl)oxamide (PubChem CID 558387) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is N'-cyclopentyl-N-(3-methoxypropyl)oxamide.

Molecular Properties

Compound NameN'-cyclopentyl-N-(3-methoxypropyl)oxamide
PubChem CID558387
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC NameN'-cyclopentyl-N-(3-methoxypropyl)oxamide
SMILESCOCCCNC(=O)C(=O)NC1CCCC1
InChIInChI=1S/C11H20N2O3/c1-16-8-4-7-12-10(14)11(15)13-9-5-2-3-6-9/h9H,2-8H2,1H3,(H,12,14)(H,13,15)
InChIKeyGXBNEYBUKHAYEA-UHFFFAOYSA-N
XLogP0.20
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.20
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'}

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Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N-(3-methoxypropyl)oxamide?
The IUPAC name of N'-cyclopentyl-N-(3-methoxypropyl)oxamide (CID 558387) is N'-cyclopentyl-N-(3-methoxypropyl)oxamide.
What is the SMILES notation for N'-cyclopentyl-N-(3-methoxypropyl)oxamide?
The canonical SMILES for N'-cyclopentyl-N-(3-methoxypropyl)oxamide is COCCCNC(=O)C(=O)NC1CCCC1.
What is the InChIKey of N'-cyclopentyl-N-(3-methoxypropyl)oxamide?
The InChIKey is GXBNEYBUKHAYEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-16-8-4-7-12-10(14)11(15)13-9-5-2-3-6-9/h9H,2-8H2,1H3,(H,12,14)(H,13,15).
What are the key properties of N'-cyclopentyl-N-(3-methoxypropyl)oxamide?
N'-cyclopentyl-N-(3-methoxypropyl)oxamide has a molecular weight of 228.29 g/mol, XLogP of 0.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N-(3-methoxypropyl)oxamide is sourced from PubChem (CID 558387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).