N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide

C19H27N3O3 — CID 16892936

IUPACN'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide
SMILESO=C(NCCN1CCOC(c2ccccc2)C1)C(=O)NC1CCCC1
InChIInChI=1S/C19H27N3O3/c23-18(19(24)21-16-8-4-5-9-16)20-10-11-22-12-13-25-17(14-22)15-6-2-1-3-7-15/h1-3,6-7,16-17H,4-5,8-14H2,(H,20,23)(H,21,24)
InChIKeyCOAXAXGHDKQYTG-UHFFFAOYSA-N
MW345.44 g/mol
LogP1.23
Rot. Bonds5

About N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide

N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide (PubChem CID 16892936) has the molecular formula C19H27N3O3 and a molecular weight of 345.44 g/mol. Its IUPAC name is N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide.

Molecular Properties

Compound NameN'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide
PubChem CID16892936
Molecular FormulaC19H27N3O3
Molecular Weight345.44 g/mol
Exact Mass345.21
IUPAC NameN'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide
SMILESO=C(NCCN1CCOC(c2ccccc2)C1)C(=O)NC1CCCC1
InChIInChI=1S/C19H27N3O3/c23-18(19(24)21-16-8-4-5-9-16)20-10-11-22-12-13-25-17(14-22)15-6-2-1-3-7-15/h1-3,6-7,16-17H,4-5,8-14H2,(H,20,23)(H,21,24)
InChIKeyCOAXAXGHDKQYTG-UHFFFAOYSA-N
XLogP1.23
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-cyclohexyl-N-[2-[(2R)-2-phenylmorpholin-4-yl]ethyl]oxamide
CID 27557907
N'-cyclopropyl-N-[4-[(2S)-2-phenylmorpholin-4-yl]butyl]oxamide
CID 27557681
N-[4-[(2R)-2-phenylmorpholin-4-yl]butyl]-N'-propan-2-yloxamide
CID 27532480
N'-(5-methyl-1,2-oxazol-3-yl)-N-[2-[(2S)-2-phenylmorpholin-4-yl]ethyl]oxamide
CID 27486360
N'-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(2R)-2-phenylmorpholin-4-yl]ethyl]oxamide
CID 27557975
N'-cyclohexyl-N-[2-(4-phenylpiperazin-1-yl)ethyl]oxamide
CID 42268287
2-chloro-N-[2-[(2S)-2-phenylmorpholin-4-yl]ethyl]benzamide
CID 51866428
N'-[(4-fluorophenyl)methyl]-N-[3-[(2R)-2-phenylmorpholin-4-yl]propyl]oxamide
CID 27557780
3-(2-phenylmorpholin-4-yl)propanoic acid
CID 119134654
N'-(2-chlorophenyl)-N-[3-[(2S)-2-phenylmorpholin-4-yl]propyl]oxamide
CID 27557843
2-(4-chlorophenoxy)-N-[2-[(2R)-2-phenylmorpholin-4-yl]ethyl]acetamide
CID 30851045
N'-(2-methoxy-5-methylphenyl)-N-[2-[(2S)-2-phenylmorpholin-4-yl]ethyl]oxamide
CID 27487199

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide?
The IUPAC name of N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide (CID 16892936) is N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide.
What is the SMILES notation for N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide?
The canonical SMILES for N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide is O=C(NCCN1CCOC(c2ccccc2)C1)C(=O)NC1CCCC1.
What is the InChIKey of N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide?
The InChIKey is COAXAXGHDKQYTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O3/c23-18(19(24)21-16-8-4-5-9-16)20-10-11-22-12-13-25-17(14-22)15-6-2-1-3-7-15/h1-3,6-7,16-17H,4-5,8-14H2,(H,20,23)(H,21,24).
What are the key properties of N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide?
N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide has a molecular weight of 345.44 g/mol, XLogP of 1.23, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N-[2-(2-phenylmorpholin-4-yl)ethyl]oxamide is sourced from PubChem (CID 16892936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).