4-[3-(4-methylthiophen-2-yl)propyl]morpholine

C12H19NOS — CID 170871201

IUPAC4-[3-(4-methylthiophen-2-yl)propyl]morpholine
SMILESCc1csc(CCCN2CCOCC2)c1
InChIInChI=1S/C12H19NOS/c1-11-9-12(15-10-11)3-2-4-13-5-7-14-8-6-13/h9-10H,2-8H2,1H3
InChIKeyUZWDJGDLBZWLIT-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.32
Rot. Bonds4

About 4-[3-(4-methylthiophen-2-yl)propyl]morpholine

4-[3-(4-methylthiophen-2-yl)propyl]morpholine (PubChem CID 170871201) has the molecular formula C12H19NOS and a molecular weight of 225.36 g/mol. Its IUPAC name is 4-[3-(4-methylthiophen-2-yl)propyl]morpholine.

Molecular Properties

Compound Name4-[3-(4-methylthiophen-2-yl)propyl]morpholine
PubChem CID170871201
Molecular FormulaC12H19NOS
Molecular Weight225.36 g/mol
Exact Mass225.12
IUPAC Name4-[3-(4-methylthiophen-2-yl)propyl]morpholine
SMILESCc1csc(CCCN2CCOCC2)c1
InChIInChI=1S/C12H19NOS/c1-11-9-12(15-10-11)3-2-4-13-5-7-14-8-6-13/h9-10H,2-8H2,1H3
InChIKeyUZWDJGDLBZWLIT-UHFFFAOYSA-N
XLogP2.32
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.32
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-(5-methyl-3-pyridinyl)propyl]morpholine
CID 70853506
4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine
CID 170871309
4-[3-[3-(4-methylphenyl)phenyl]propyl]morpholine
CID 170869539
4-(3-pyrimidin-2-ylpropyl)morpholine
CID 170871392
5-methyl-4-(3-morpholin-4-ylpropyl)benzene-1,3-diol
CID 170869328
4-[3-(2,5,7-trimethyl-1H-indol-3-yl)propyl]morpholine
CID 170871014
1-(5-methylthiophen-3-yl)-5-morpholin-4-ylpentan-1-one
CID 159482054
4-[3-(4-bromo-2-methylphenyl)propyl]morpholine
CID 170870052
3,5-difluoro-4-(3-morpholin-4-ylpropyl)phenol
CID 170869741
4-[3-(4-chloro-1-benzothiophen-2-yl)propyl]morpholine
CID 170870855
4-chloro-3,5-dimethyl-2-(3-morpholin-4-ylpropyl)phenol
CID 170869854

Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-methylthiophen-2-yl)propyl]morpholine?
The IUPAC name of 4-[3-(4-methylthiophen-2-yl)propyl]morpholine (CID 170871201) is 4-[3-(4-methylthiophen-2-yl)propyl]morpholine.
What is the SMILES notation for 4-[3-(4-methylthiophen-2-yl)propyl]morpholine?
The canonical SMILES for 4-[3-(4-methylthiophen-2-yl)propyl]morpholine is Cc1csc(CCCN2CCOCC2)c1.
What is the InChIKey of 4-[3-(4-methylthiophen-2-yl)propyl]morpholine?
The InChIKey is UZWDJGDLBZWLIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NOS/c1-11-9-12(15-10-11)3-2-4-13-5-7-14-8-6-13/h9-10H,2-8H2,1H3.
What are the key properties of 4-[3-(4-methylthiophen-2-yl)propyl]morpholine?
4-[3-(4-methylthiophen-2-yl)propyl]morpholine has a molecular weight of 225.36 g/mol, XLogP of 2.32, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-methylthiophen-2-yl)propyl]morpholine is sourced from PubChem (CID 170871201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).