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

C12H19N3O2S — CID 83101539

IUPAC4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide
SMILESCC(N)C(c1ccsc1)N1CCOCC1C(N)=O
InChIInChI=1S/C12H19N3O2S/c1-8(13)11(9-2-5-18-7-9)15-3-4-17-6-10(15)12(14)16/h2,5,7-8,10-11H,3-4,6,13H2,1H3,(H2,14,16)
InChIKeyIWWAVUCHLBXRDE-UHFFFAOYSA-N
MW269.37 g/mol
LogP0.32
Rot. Bonds4

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

4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide (PubChem CID 83101539) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is 4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide.

Molecular Properties

Compound Name4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide
PubChem CID83101539
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC Name4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide
SMILESCC(N)C(c1ccsc1)N1CCOCC1C(N)=O
InChIInChI=1S/C12H19N3O2S/c1-8(13)11(9-2-5-18-7-9)15-3-4-17-6-10(15)12(14)16/h2,5,7-8,10-11H,3-4,6,13H2,1H3,(H2,14,16)
InChIKeyIWWAVUCHLBXRDE-UHFFFAOYSA-N
XLogP0.32
TPSA81.58 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(2-amino-1-thiophen-3-ylethyl)morpholine-3-carboxamide
CID 83102015
4-[2-amino-1-(1-methylpyrazol-4-yl)propyl]morpholine-3-carboxamide
CID 83101068
4-(2-amino-1-thiophen-2-ylpropyl)-N-cyclopropylmorpholine-3-carboxamide
CID 83098163
4-[2-amino-2-(4-methylphenyl)acetyl]morpholine-3-carboxamide
CID 106312666
4-(4-oxopentan-2-yl)morpholine-3-carboxamide
CID 83096571
4-[(1R)-1-naphthalen-1-ylethyl]morpholine-3-carboxamide
CID 140628038
4-[2-amino-1-(5-bromothiophen-2-yl)propyl]-N-methylmorpholine-3-carboxamide
CID 83106857
1-[2-amino-1-(4-methylphenyl)propyl]pyrrolidine-2-carboxamide
CID 55016470
4-(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)morpholine-3-carboxamide
CID 83095756
1-(2-amino-1-phenylpropyl)pyrrolidine-2-carboxamide
CID 55017137
1-[3-(5-methyl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]-2-thiophen-3-ylpropan-1-one
CID 129004647
4-(2-aminopropanoyl)morpholine-3-carboxamide
CID 83101341

Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide?
The IUPAC name of 4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide (CID 83101539) is 4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide.
What is the SMILES notation for 4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide?
The canonical SMILES for 4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide is CC(N)C(c1ccsc1)N1CCOCC1C(N)=O.
What is the InChIKey of 4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide?
The InChIKey is IWWAVUCHLBXRDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-8(13)11(9-2-5-18-7-9)15-3-4-17-6-10(15)12(14)16/h2,5,7-8,10-11H,3-4,6,13H2,1H3,(H2,14,16).
What are the key properties of 4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide?
4-(2-amino-1-thiophen-3-ylpropyl)morpholine-3-carboxamide has a molecular weight of 269.37 g/mol, XLogP of 0.32, 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-ylpropyl)morpholine-3-carboxamide is sourced from PubChem (CID 83101539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).