4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide

C13H23N3O3 — CID 116657394

IUPAC4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide
SMILESCCNC(=O)C1COCCN1C(=O)NC1CCCC1
InChIInChI=1S/C13H23N3O3/c1-2-14-12(17)11-9-19-8-7-16(11)13(18)15-10-5-3-4-6-10/h10-11H,2-9H2,1H3,(H,14,17)(H,15,18)
InChIKeyPCVWMMLGPYCQMU-UHFFFAOYSA-N
MW269.34 g/mol
LogP0.48
Rot. Bonds3

About 4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide

4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide (PubChem CID 116657394) has the molecular formula C13H23N3O3 and a molecular weight of 269.34 g/mol. Its IUPAC name is 4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide.

Molecular Properties

Compound Name4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide
PubChem CID116657394
Molecular FormulaC13H23N3O3
Molecular Weight269.34 g/mol
Exact Mass269.17
IUPAC Name4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide
SMILESCCNC(=O)C1COCCN1C(=O)NC1CCCC1
InChIInChI=1S/C13H23N3O3/c1-2-14-12(17)11-9-19-8-7-16(11)13(18)15-10-5-3-4-6-10/h10-11H,2-9H2,1H3,(H,14,17)(H,15,18)
InChIKeyPCVWMMLGPYCQMU-UHFFFAOYSA-N
XLogP0.48
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide
CID 116657396
2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid
CID 83103608
3-N-ethylmorpholine-3,4-dicarboxamide
CID 83106248
4-[2-(cyclopropylamino)acetyl]-N-ethylmorpholine-3-carboxamide
CID 83099136
methyl 3-(ethylcarbamoyl)morpholine-4-carboxylate
CID 116657408
2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]butanoic acid
CID 83103752
N-ethyl-4-[(2R)-pyrrolidine-2-carbonyl]morpholine-3-carboxamide
CID 104901407
3-N-cyclopropyl-4-N-methylmorpholine-3,4-dicarboxamide
CID 116657472
4-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]-2-hydroxybutanoic acid
CID 107840814
N-ethyl-4-[3-(ethylamino)propanoyl]morpholine-3-carboxamide
CID 83099263
1-[3-(ethylcarbamoyl)morpholine-4-carbonyl]cyclobutane-1-carboxylic acid
CID 83103065
3-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]-2-methoxypropanoic acid
CID 106110427

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide?
The IUPAC name of 4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide (CID 116657394) is 4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide.
What is the SMILES notation for 4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide?
The canonical SMILES for 4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide is CCNC(=O)C1COCCN1C(=O)NC1CCCC1.
What is the InChIKey of 4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide?
The InChIKey is PCVWMMLGPYCQMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O3/c1-2-14-12(17)11-9-19-8-7-16(11)13(18)15-10-5-3-4-6-10/h10-11H,2-9H2,1H3,(H,14,17)(H,15,18).
What are the key properties of 4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide?
4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide has a molecular weight of 269.34 g/mol, XLogP of 0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide is sourced from PubChem (CID 116657394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).