2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one

C12H17ClN2O3 — CID 112683112

IUPAC2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one
SMILESCC(NCc1ccc(Cl)o1)C(=O)N1CCOCC1
InChIInChI=1S/C12H17ClN2O3/c1-9(12(16)15-4-6-17-7-5-15)14-8-10-2-3-11(13)18-10/h2-3,9,14H,4-8H2,1H3
InChIKeyBMGNORZIWYKIPJ-UHFFFAOYSA-N
MW272.73 g/mol
LogP1.27
Rot. Bonds4

About 2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one

2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one (PubChem CID 112683112) has the molecular formula C12H17ClN2O3 and a molecular weight of 272.73 g/mol. Its IUPAC name is 2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one
PubChem CID112683112
Molecular FormulaC12H17ClN2O3
Molecular Weight272.73 g/mol
Exact Mass272.09
IUPAC Name2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one
SMILESCC(NCc1ccc(Cl)o1)C(=O)N1CCOCC1
InChIInChI=1S/C12H17ClN2O3/c1-9(12(16)15-4-6-17-7-5-15)14-8-10-2-3-11(13)18-10/h2-3,9,14H,4-8H2,1H3
InChIKeyBMGNORZIWYKIPJ-UHFFFAOYSA-N
XLogP1.27
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.73
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one 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

2-[[5-(methylsulfanylmethyl)furan-2-yl]methylamino]-1-morpholin-4-ylpropan-1-one
CID 115621805
methyl 5-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]furan-2-carboxylate
CID 115628854
2-[[5-(2-methylcyclopropyl)furan-2-yl]methylamino]-1-morpholin-4-ylpropan-1-one
CID 115588959
2-[(4-bromo-2-chlorophenyl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 115595203
2-[(4-fluorophenyl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 43083712
2-[(3-chloro-4-methoxyphenyl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 115653757
4-[[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]methyl]benzamide
CID 115569779
2-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 106371542
2-[(4-ethoxyphenyl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 115593323
2-[(5-chlorofuran-2-yl)methylamino]-N-ethyl-N-methylpropanamide
CID 103107113
2-[(2,5-dimethylthiophen-3-yl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 115663838
2-[(3-methylimidazol-4-yl)methylamino]-1-morpholin-4-ylpropan-1-one
CID 112690593

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one (CID 112683112) is 2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one is CC(NCc1ccc(Cl)o1)C(=O)N1CCOCC1.
What is the InChIKey of 2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one?
The InChIKey is BMGNORZIWYKIPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2O3/c1-9(12(16)15-4-6-17-7-5-15)14-8-10-2-3-11(13)18-10/h2-3,9,14H,4-8H2,1H3.
What are the key properties of 2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one?
2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one has a molecular weight of 272.73 g/mol, XLogP of 1.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chlorofuran-2-yl)methylamino]-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 112683112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).