4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide

C12H21N5O3 — CID 106963754

IUPAC4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide
SMILESCCCNC(=O)C1COCCN1c1nnc(C(C)N)o1
InChIInChI=1S/C12H21N5O3/c1-3-4-14-10(18)9-7-19-6-5-17(9)12-16-15-11(20-12)8(2)13/h8-9H,3-7,13H2,1-2H3,(H,14,18)
InChIKeyFKPVAVIPWSTWRN-UHFFFAOYSA-N
MW283.33 g/mol
LogP-0.18
Rot. Bonds5

About 4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide

4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide (PubChem CID 106963754) has the molecular formula C12H21N5O3 and a molecular weight of 283.33 g/mol. Its IUPAC name is 4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide
PubChem CID106963754
Molecular FormulaC12H21N5O3
Molecular Weight283.33 g/mol
Exact Mass283.16
IUPAC Name4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide
SMILESCCCNC(=O)C1COCCN1c1nnc(C(C)N)o1
InChIInChI=1S/C12H21N5O3/c1-3-4-14-10(18)9-7-19-6-5-17(9)12-16-15-11(20-12)8(2)13/h8-9H,3-7,13H2,1-2H3,(H,14,18)
InChIKeyFKPVAVIPWSTWRN-UHFFFAOYSA-N
XLogP-0.18
TPSA106.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(3,6-dichloro-1,2,4-triazin-5-yl)-N-propylmorpholine-3-carboxamide
CID 83103198
3-N-propylmorpholine-3,4-dicarboxamide
CID 83106321
[4-[5-[1-(propylamino)ethyl]-1,3,4-oxadiazol-2-yl]morpholin-3-yl]methanol
CID 106965567
4-(5-amino-3-pyridinyl)-N-propylmorpholine-3-carboxamide
CID 104535679
4-[6-(1-hydroxyethyl)-3-pyridinyl]-N-propylmorpholine-3-carboxamide
CID 83110890
4-(2-amino-6-hydrazinylpyrimidin-4-yl)-N-propylmorpholine-3-carboxamide
CID 83104525
4-(3-oxobutan-2-yl)-N-propylmorpholine-3-carboxamide
CID 83103248
6-[3-(propylcarbamoyl)morpholin-4-yl]pyridine-3-carboxylic acid
CID 83102742
4-[4-(hydroxymethyl)-1,3-dimethylpyrazol-5-yl]-N-propylmorpholine-3-carboxamide
CID 83101398
4-(3-amino-5-chloro-2-pyridinyl)-N-propylmorpholine-3-carboxamide
CID 83106772
4-(2-amino-3-cyanophenyl)-N-propylmorpholine-3-carboxamide
CID 104717015
4-(2-fluoro-4-pyridinyl)-N-propylmorpholine-3-carboxamide
CID 113367388

Frequently Asked Questions

What is the IUPAC name of 4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide?
The IUPAC name of 4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide (CID 106963754) is 4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide.
What is the SMILES notation for 4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide?
The canonical SMILES for 4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide is CCCNC(=O)C1COCCN1c1nnc(C(C)N)o1.
What is the InChIKey of 4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide?
The InChIKey is FKPVAVIPWSTWRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O3/c1-3-4-14-10(18)9-7-19-6-5-17(9)12-16-15-11(20-12)8(2)13/h8-9H,3-7,13H2,1-2H3,(H,14,18).
What are the key properties of 4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide?
4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide has a molecular weight of 283.33 g/mol, XLogP of -0.18, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(1-aminoethyl)-1,3,4-oxadiazol-2-yl]-N-propylmorpholine-3-carboxamide is sourced from PubChem (CID 106963754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).