4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide

C11H17N3O2S — CID 83102015

IUPAC4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide
SMILESNCC(c1ccsc1)N1CCOCC1C(N)=O
InChIInChI=1S/C11H17N3O2S/c12-5-9(8-1-4-17-7-8)14-2-3-16-6-10(14)11(13)15/h1,4,7,9-10H,2-3,5-6,12H2,(H2,13,15)
InChIKeyVTRAUPVFSNQYOA-UHFFFAOYSA-N
MW255.34 g/mol
LogP-0.07
Rot. Bonds4

About 4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide

4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide (PubChem CID 83102015) has the molecular formula C11H17N3O2S and a molecular weight of 255.34 g/mol. Its IUPAC name is 4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide.

Molecular Properties

Compound Name4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide
PubChem CID83102015
Molecular FormulaC11H17N3O2S
Molecular Weight255.34 g/mol
Exact Mass255.10
IUPAC Name4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide
SMILESNCC(c1ccsc1)N1CCOCC1C(N)=O
InChIInChI=1S/C11H17N3O2S/c12-5-9(8-1-4-17-7-8)14-2-3-16-6-10(14)11(13)15/h1,4,7,9-10H,2-3,5-6,12H2,(H2,13,15)
InChIKeyVTRAUPVFSNQYOA-UHFFFAOYSA-N
XLogP-0.07
TPSA81.58 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide
CID 83101539
4-[2-amino-1-(3-fluorophenyl)ethyl]morpholine-3-carboxamide
CID 83102016
4-(2-amino-1-pyridin-4-ylethyl)-N-propylmorpholine-3-carboxamide
CID 83097966
4-[2-amino-1-(5-methylfuran-2-yl)ethyl]-N-ethylmorpholine-3-carboxamide
CID 83106718
4-[[4-(aminomethyl)phenyl]methyl]morpholine-3-carboxamide
CID 83101444
4-(2-amino-1-thiophen-3-ylethyl)-3-methylpiperazin-2-one
CID 63595243
N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)cyclopropanecarboxamide
CID 16931690
4-[2-amino-1-(2-chlorophenyl)propyl]morpholine-3-carboxamide
CID 83101200
4-[(1R)-1-naphthalen-1-ylethyl]morpholine-3-carboxamide
CID 140628038
4-(4-oxopentan-2-yl)morpholine-3-carboxamide
CID 83096571
2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-thiophen-3-ylethanamine
CID 55011117
4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide
CID 83101068

Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide?
The IUPAC name of 4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide (CID 83102015) is 4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide.
What is the SMILES notation for 4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide?
The canonical SMILES for 4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide is NCC(c1ccsc1)N1CCOCC1C(N)=O.
What is the InChIKey of 4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide?
The InChIKey is VTRAUPVFSNQYOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2S/c12-5-9(8-1-4-17-7-8)14-2-3-16-6-10(14)11(13)15/h1,4,7,9-10H,2-3,5-6,12H2,(H2,13,15).
What are the key properties of 4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide?
4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide has a molecular weight of 255.34 g/mol, XLogP of -0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide is sourced from PubChem (CID 83102015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).