3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide

C11H21N3O3 — CID 116657396

IUPAC3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide
SMILESCCNC(=O)C1COCCN1C(=O)NC(C)C
InChIInChI=1S/C11H21N3O3/c1-4-12-10(15)9-7-17-6-5-14(9)11(16)13-8(2)3/h8-9H,4-7H2,1-3H3,(H,12,15)(H,13,16)
InChIKeyQRVWFTWHNNFXSF-UHFFFAOYSA-N
MW243.31 g/mol
LogP-0.06
Rot. Bonds3

About 3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide

3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide (PubChem CID 116657396) has the molecular formula C11H21N3O3 and a molecular weight of 243.31 g/mol. Its IUPAC name is 3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide.

Molecular Properties

Compound Name3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide
PubChem CID116657396
Molecular FormulaC11H21N3O3
Molecular Weight243.31 g/mol
Exact Mass243.16
IUPAC Name3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide
SMILESCCNC(=O)C1COCCN1C(=O)NC(C)C
InChIInChI=1S/C11H21N3O3/c1-4-12-10(15)9-7-17-6-5-14(9)11(16)13-8(2)3/h8-9H,4-7H2,1-3H3,(H,12,15)(H,13,16)
InChIKeyQRVWFTWHNNFXSF-UHFFFAOYSA-N
XLogP-0.06
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]butanoic acid
CID 83103752
(2R)-2-[[3-(propan-2-ylcarbamoyl)morpholine-4-carbonyl]amino]butanoic acid
CID 83104584
4-N-cyclopentyl-3-N-ethylmorpholine-3,4-dicarboxamide
CID 116657394
2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]acetic acid
CID 83103608
2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]pent-4-enoic acid
CID 83104278
3-N-ethylmorpholine-3,4-dicarboxamide
CID 83106248
methyl 3-(ethylcarbamoyl)morpholine-4-carboxylate
CID 116657408
4-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]-2-hydroxybutanoic acid
CID 107840814
3-N-propan-2-yl-4-N-(2,2,2-trifluoroethyl)morpholine-3,4-dicarboxamide
CID 116657490
(2S)-3-hydroxy-2-[[3-(propylcarbamoyl)morpholine-4-carbonyl]amino]propanoic acid
CID 83104546
3-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]amino]-2-methoxypropanoic acid
CID 106110427
2-[[3-(ethylcarbamoyl)morpholine-4-carbonyl]-methylamino]acetic acid
CID 83103394

Frequently Asked Questions

What is the IUPAC name of 3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide?
The IUPAC name of 3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide (CID 116657396) is 3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide.
What is the SMILES notation for 3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide?
The canonical SMILES for 3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide is CCNC(=O)C1COCCN1C(=O)NC(C)C.
What is the InChIKey of 3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide?
The InChIKey is QRVWFTWHNNFXSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O3/c1-4-12-10(15)9-7-17-6-5-14(9)11(16)13-8(2)3/h8-9H,4-7H2,1-3H3,(H,12,15)(H,13,16).
What are the key properties of 3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide?
3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide has a molecular weight of 243.31 g/mol, XLogP of -0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-ethyl-4-N-propan-2-ylmorpholine-3,4-dicarboxamide is sourced from PubChem (CID 116657396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).