4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide

C14H23N3O3 — CID 83106718

IUPAC4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1C(CN)c1ccc(C)o1
InChIInChI=1S/C14H23N3O3/c1-3-16-14(18)12-9-19-7-6-17(12)11(8-15)13-5-4-10(2)20-13/h4-5,11-12H,3,6-9,15H2,1-2H3,(H,16,18)
InChIKeyMYYRRWFZGKFZNJ-UHFFFAOYSA-N
MW281.36 g/mol
LogP0.42
Rot. Bonds5

About 4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide

4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide (PubChem CID 83106718) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is 4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide
PubChem CID83106718
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1C(CN)c1ccc(C)o1
InChIInChI=1S/C14H23N3O3/c1-3-16-14(18)12-9-19-7-6-17(12)11(8-15)13-5-4-10(2)20-13/h4-5,11-12H,3,6-9,15H2,1-2H3,(H,16,18)
InChIKeyMYYRRWFZGKFZNJ-UHFFFAOYSA-N
XLogP0.42
TPSA80.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-amino-1-pyridin-4-ylethyl)-N-propylmorpholine-3-carboxamide
CID 83097966
5-[1-[3-(ethylcarbamoyl)morpholin-4-yl]ethyl]furan-2-carboxylic acid
CID 83100910
4-(2-amino-1-phenylpropyl)-N-ethylmorpholine-3-carboxamide
CID 83097771
4-(1-aminopentan-3-yl)-N-ethylmorpholine-3-carboxamide
CID 83106656
4-(1-amino-1-oxobutan-2-yl)-N-ethylmorpholine-3-carboxamide
CID 83103788
2-[3-(ethylcarbamoyl)morpholin-4-yl]butanoic acid
CID 83099705
4-(3-amino-2-phenylpropyl)-N-ethylmorpholine-3-carboxamide
CID 83098381
4-(4-amino-2,2-dimethylpentan-3-yl)-N-ethylmorpholine-3-carboxamide
CID 83106921
3-amino-2-[3-(propylcarbamoyl)morpholin-4-yl]propanoic acid
CID 114242234
4-[5-(aminomethyl)-2-pyridinyl]-N-ethylmorpholine-3-carboxamide
CID 83107123
2-[3-(ethylcarbamoyl)morpholin-4-yl]pentanoic acid
CID 83100616
4-(3-amino-2-methylpropyl)-N-ethylmorpholine-3-carboxamide
CID 83106373

Frequently Asked Questions

What is the IUPAC name of 4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide?
The IUPAC name of 4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide (CID 83106718) is 4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide.
What is the SMILES notation for 4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide?
The canonical SMILES for 4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide is CCNC(=O)C1COCCN1C(CN)c1ccc(C)o1.
What is the InChIKey of 4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide?
The InChIKey is MYYRRWFZGKFZNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-3-16-14(18)12-9-19-7-6-17(12)11(8-15)13-5-4-10(2)20-13/h4-5,11-12H,3,6-9,15H2,1-2H3,(H,16,18).
What are the key properties of 4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide?
4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 0.42, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide is sourced from PubChem (CID 83106718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).