1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone

C19H23NO3S — CID 175493437

IUPAC1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone
SMILESCC(=O)c1cscc1OCc1ccc(CCN2CCOCC2)cc1
InChIInChI=1S/C19H23NO3S/c1-15(21)18-13-24-14-19(18)23-12-17-4-2-16(3-5-17)6-7-20-8-10-22-11-9-20/h2-5,13-14H,6-12H2,1H3
InChIKeyBPFUGGCHSYJJEW-UHFFFAOYSA-N
MW345.46 g/mol
LogP3.40
Rot. Bonds7

About 1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone

1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone (PubChem CID 175493437) has the molecular formula C19H23NO3S and a molecular weight of 345.46 g/mol. Its IUPAC name is 1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone.

Molecular Properties

Compound Name1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone
PubChem CID175493437
Molecular FormulaC19H23NO3S
Molecular Weight345.46 g/mol
Exact Mass345.14
IUPAC Name1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone
SMILESCC(=O)c1cscc1OCc1ccc(CCN2CCOCC2)cc1
InChIInChI=1S/C19H23NO3S/c1-15(21)18-13-24-14-19(18)23-12-17-4-2-16(3-5-17)6-7-20-8-10-22-11-9-20/h2-5,13-14H,6-12H2,1H3
InChIKeyBPFUGGCHSYJJEW-UHFFFAOYSA-N
XLogP3.40
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.46
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone with MolForge

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Related Compounds

2-methyl-5-(2-morpholin-4-ylethyl)benzoic acid
CID 70846219
3-[4-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]triazol-1-yl]piperidine-2,6-dione
CID 150892676
4-[2-(4-fluorophenyl)ethyl]morpholine
CID 100965302
N-methyl-4-[4-(2-morpholin-4-ylethyl)phenyl]benzamide
CID 71133573
4-(4-morpholin-4-ylbutyl)phenol
CID 82188001
1-[5-(3-morpholin-4-ylpropyl)furan-2-yl]ethanone
CID 162740835
1-[4-(2-morpholin-4-ylethyl)phenyl]cyclopropane-1-carboxylic acid
CID 117440559
S-amino 6-[4-(2-morpholin-4-ylethyl)phenoxy]pyridine-3-carbothioate;ethane
CID 142876359
methane;4-(2-phenylethyl)morpholine
CID 143698819
2-(cyclopropylmethylamino)-N-[4-(2-morpholin-4-ylethyl)phenyl]acetamide;dihydrochloride
CID 119860951
4-[3-[3-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl]propyl]morpholine
CID 170870151
1-[[4-(2-morpholin-4-ylethyl)phenyl]methyl]cyclopropan-1-ol
CID 117408221

Frequently Asked Questions

What is the IUPAC name of 1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone?
The IUPAC name of 1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone (CID 175493437) is 1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone.
What is the SMILES notation for 1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone?
The canonical SMILES for 1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone is CC(=O)c1cscc1OCc1ccc(CCN2CCOCC2)cc1.
What is the InChIKey of 1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone?
The InChIKey is BPFUGGCHSYJJEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3S/c1-15(21)18-13-24-14-19(18)23-12-17-4-2-16(3-5-17)6-7-20-8-10-22-11-9-20/h2-5,13-14H,6-12H2,1H3.
What are the key properties of 1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone?
1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone has a molecular weight of 345.46 g/mol, XLogP of 3.40, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[[4-(2-morpholin-4-ylethyl)phenyl]methoxy]thiophen-3-yl]ethanone is sourced from PubChem (CID 175493437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).