4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine

C13H21NO2 — CID 170871309

IUPAC4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine
SMILESCc1cc(CCCN2CCOCC2)oc1C
InChIInChI=1S/C13H21NO2/c1-11-10-13(16-12(11)2)4-3-5-14-6-8-15-9-7-14/h10H,3-9H2,1-2H3
InChIKeyQGZFYASBCPYOHE-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.16
Rot. Bonds4

About 4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine

4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine (PubChem CID 170871309) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine.

Molecular Properties

Compound Name4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine
PubChem CID170871309
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine
SMILESCc1cc(CCCN2CCOCC2)oc1C
InChIInChI=1S/C13H21NO2/c1-11-10-13(16-12(11)2)4-3-5-14-6-8-15-9-7-14/h10H,3-9H2,1-2H3
InChIKeyQGZFYASBCPYOHE-UHFFFAOYSA-N
XLogP2.16
TPSA25.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-[3,5-bis(3-morpholin-4-ylpropyl)phenyl]propyl]morpholine
CID 170870147
4-[3-(4-bromo-2-methylphenyl)propyl]morpholine
CID 170870052
5-methyl-4-(3-morpholin-4-ylpropyl)benzene-1,3-diol
CID 170869328
4-[3-(5-methyl-3-pyridinyl)propyl]morpholine
CID 70853506
4-[3-(4-methylthiophen-2-yl)propyl]morpholine
CID 170871201
4-[3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]propyl]morpholine
CID 170871274
4-chloro-3,5-dimethyl-2-(3-morpholin-4-ylpropyl)phenol
CID 170869854
1-[5-(3-morpholin-4-ylpropyl)furan-2-yl]ethanone
CID 162740835
4-[3-(2,5,7-trimethyl-1H-indol-3-yl)propyl]morpholine
CID 170871014
3,5-difluoro-4-(3-morpholin-4-ylpropyl)phenol
CID 170869741
N,N-diethyl-3-methyl-4-(3-morpholin-4-ylpropyl)aniline
CID 170870635
4-[3-(2-bromo-6-fluoro-3-methylphenyl)propyl]morpholine
CID 170869770

Frequently Asked Questions

What is the IUPAC name of 4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine?
The IUPAC name of 4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine (CID 170871309) is 4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine.
What is the SMILES notation for 4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine?
The canonical SMILES for 4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine is Cc1cc(CCCN2CCOCC2)oc1C.
What is the InChIKey of 4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine?
The InChIKey is QGZFYASBCPYOHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-11-10-13(16-12(11)2)4-3-5-14-6-8-15-9-7-14/h10H,3-9H2,1-2H3.
What are the key properties of 4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine?
4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine has a molecular weight of 223.32 g/mol, XLogP of 2.16, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine is sourced from PubChem (CID 170871309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).