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

C10H15NOS — CID 782873

IUPAC4-[(3-methylthiophen-2-yl)methyl]morpholine
SMILESCc1ccsc1CN1CCOCC1
InChIInChI=1S/C10H15NOS/c1-9-2-7-13-10(9)8-11-3-5-12-6-4-11/h2,7H,3-6,8H2,1H3
InChIKeyRUVLGSHKRVSEAA-UHFFFAOYSA-N
MW197.30 g/mol
LogP1.89
Rot. Bonds2

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

4-[(3-methylthiophen-2-yl)methyl]morpholine (PubChem CID 782873) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is 4-[(3-methylthiophen-2-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(3-methylthiophen-2-yl)methyl]morpholine
PubChem CID782873
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC Name4-[(3-methylthiophen-2-yl)methyl]morpholine
SMILESCc1ccsc1CN1CCOCC1
InChIInChI=1S/C10H15NOS/c1-9-2-7-13-10(9)8-11-3-5-12-6-4-11/h2,7H,3-6,8H2,1H3
InChIKeyRUVLGSHKRVSEAA-UHFFFAOYSA-N
XLogP1.89
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(3-methylthiophen-2-yl)methyl]morpholine?
The IUPAC name of 4-[(3-methylthiophen-2-yl)methyl]morpholine (CID 782873) is 4-[(3-methylthiophen-2-yl)methyl]morpholine.
What is the SMILES notation for 4-[(3-methylthiophen-2-yl)methyl]morpholine?
The canonical SMILES for 4-[(3-methylthiophen-2-yl)methyl]morpholine is Cc1ccsc1CN1CCOCC1.
What is the InChIKey of 4-[(3-methylthiophen-2-yl)methyl]morpholine?
The InChIKey is RUVLGSHKRVSEAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NOS/c1-9-2-7-13-10(9)8-11-3-5-12-6-4-11/h2,7H,3-6,8H2,1H3.
What are the key properties of 4-[(3-methylthiophen-2-yl)methyl]morpholine?
4-[(3-methylthiophen-2-yl)methyl]morpholine has a molecular weight of 197.30 g/mol, XLogP of 1.89, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methylthiophen-2-yl)methyl]morpholine is sourced from PubChem (CID 782873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).