2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine

C17H22N2O2S2 — CID 3742360

IUPAC2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine
SMILESCSc1ccc(CN2CCOC(COc3ccc(C)nc3)C2)s1
InChIInChI=1S/C17H22N2O2S2/c1-13-3-4-14(9-18-13)21-12-15-10-19(7-8-20-15)11-16-5-6-17(22-2)23-16/h3-6,9,15H,7-8,10-12H2,1-2H3
InChIKeyBAQPMYRRYRLXNP-UHFFFAOYSA-N
MW350.51 g/mol
LogP3.45
Rot. Bonds6

About 2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine

2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine (PubChem CID 3742360) has the molecular formula C17H22N2O2S2 and a molecular weight of 350.51 g/mol. Its IUPAC name is 2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine.

Molecular Properties

Compound Name2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine
PubChem CID3742360
Molecular FormulaC17H22N2O2S2
Molecular Weight350.51 g/mol
Exact Mass350.11
IUPAC Name2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine
SMILESCSc1ccc(CN2CCOC(COc3ccc(C)nc3)C2)s1
InChIInChI=1S/C17H22N2O2S2/c1-13-3-4-14(9-18-13)21-12-15-10-19(7-8-20-15)11-16-5-6-17(22-2)23-16/h3-6,9,15H,7-8,10-12H2,1-2H3
InChIKeyBAQPMYRRYRLXNP-UHFFFAOYSA-N
XLogP3.45
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.51
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine with MolForge

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Related Compounds

1-[2-fluoro-4-[[4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholin-2-yl]methoxy]phenyl]ethanone
CID 3771703
methyl 3-[4-[[4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholin-2-yl]methoxy]phenyl]-3-oxopropanoate
CID 3678633
(2-fluoro-3-pyridinyl)-[2-[(6-methyl-3-pyridinyl)oxymethyl]morpholin-4-yl]methanone
CID 5016333
N-[[5-[(4-ethylmorpholin-2-yl)methoxy]-2-pyridinyl]methyl]cyclopropanamine
CID 79782914
1-[5-[(4-ethylmorpholin-2-yl)methoxy]-2-pyridinyl]propan-2-amine
CID 79800444
1-[(5-methylsulfanylthiophen-2-yl)methyl]azetidine
CID 130877389
4-ethyl-2-[[4-(morpholin-4-ylmethyl)phenoxy]methyl]morpholine
CID 44581056
5-[(4-ethylmorpholin-2-yl)methoxy]-2-methylaniline
CID 114252444
4-[(3-methylthiophen-2-yl)methyl]-2-(pyrimidin-2-yloxymethyl)morpholine
CID 74228170
1-[2-methyl-4-[[4-[(3-methylthiophen-2-yl)methyl]morpholin-2-yl]methoxy]phenyl]ethanone
CID 74225388
4-ethyl-2-[(5-fluoro-2-methylphenoxy)methyl]morpholine
CID 102990646
1-[3-[(4-ethylmorpholin-2-yl)methoxy]-6-methyl-2-pyridinyl]-N-methylmethanamine
CID 79167041

Frequently Asked Questions

What is the IUPAC name of 2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine?
The IUPAC name of 2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine (CID 3742360) is 2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine.
What is the SMILES notation for 2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine?
The canonical SMILES for 2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine is CSc1ccc(CN2CCOC(COc3ccc(C)nc3)C2)s1.
What is the InChIKey of 2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine?
The InChIKey is BAQPMYRRYRLXNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2S2/c1-13-3-4-14(9-18-13)21-12-15-10-19(7-8-20-15)11-16-5-6-17(22-2)23-16/h3-6,9,15H,7-8,10-12H2,1-2H3.
What are the key properties of 2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine?
2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine has a molecular weight of 350.51 g/mol, XLogP of 3.45, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methyl-3-pyridinyl)oxymethyl]-4-[(5-methylsulfanylthiophen-2-yl)methyl]morpholine is sourced from PubChem (CID 3742360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).