N'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide

C15H27N3O3 — CID 3157871

IUPACN'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide
SMILESO=C(NCCCN1CCOCC1)C(=O)NC1CCCCC1
InChIInChI=1S/C15H27N3O3/c19-14(15(20)17-13-5-2-1-3-6-13)16-7-4-8-18-9-11-21-12-10-18/h13H,1-12H2,(H,16,19)(H,17,20)
InChIKeyYZLIITZMZBLZFH-UHFFFAOYSA-N
MW297.40 g/mol
LogP0.27
Rot. Bonds5

About N'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide

N'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide (PubChem CID 3157871) has the molecular formula C15H27N3O3 and a molecular weight of 297.40 g/mol. Its IUPAC name is N'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide.

Molecular Properties

Compound NameN'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide
PubChem CID3157871
Molecular FormulaC15H27N3O3
Molecular Weight297.40 g/mol
Exact Mass297.21
IUPAC NameN'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide
SMILESO=C(NCCCN1CCOCC1)C(=O)NC1CCCCC1
InChIInChI=1S/C15H27N3O3/c19-14(15(20)17-13-5-2-1-3-6-13)16-7-4-8-18-9-11-21-12-10-18/h13H,1-12H2,(H,16,19)(H,17,20)
InChIKeyYZLIITZMZBLZFH-UHFFFAOYSA-N
XLogP0.27
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide?
The IUPAC name of N'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide (CID 3157871) is N'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide.
What is the SMILES notation for N'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide?
The canonical SMILES for N'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide is O=C(NCCCN1CCOCC1)C(=O)NC1CCCCC1.
What is the InChIKey of N'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide?
The InChIKey is YZLIITZMZBLZFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O3/c19-14(15(20)17-13-5-2-1-3-6-13)16-7-4-8-18-9-11-21-12-10-18/h13H,1-12H2,(H,16,19)(H,17,20).
What are the key properties of N'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide?
N'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide has a molecular weight of 297.40 g/mol, XLogP of 0.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclohexyl-N-(3-morpholin-4-ylpropyl)oxamide is sourced from PubChem (CID 3157871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).