2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide

C18H21FN2O2S — CID 30604991

IUPAC2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide
SMILESO=C(Cc1ccc(F)cc1)NC[C@@H](c1ccsc1)N1CCOCC1
InChIInChI=1S/C18H21FN2O2S/c19-16-3-1-14(2-4-16)11-18(22)20-12-17(15-5-10-24-13-15)21-6-8-23-9-7-21/h1-5,10,13,17H,6-9,11-12H2,(H,20,22)/t17-/m0/s1
InChIKeyGKYWQXURPMZHQN-KRWDZBQOSA-N
MW348.44 g/mol
LogP2.62
Rot. Bonds6

About 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide

2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide (PubChem CID 30604991) has the molecular formula C18H21FN2O2S and a molecular weight of 348.44 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide
PubChem CID30604991
Molecular FormulaC18H21FN2O2S
Molecular Weight348.44 g/mol
Exact Mass348.13
IUPAC Name2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide
SMILESO=C(Cc1ccc(F)cc1)NC[C@@H](c1ccsc1)N1CCOCC1
InChIInChI=1S/C18H21FN2O2S/c19-16-3-1-14(2-4-16)11-18(22)20-12-17(15-5-10-24-13-15)21-6-8-23-9-7-21/h1-5,10,13,17H,6-9,11-12H2,(H,20,22)/t17-/m0/s1
InChIKeyGKYWQXURPMZHQN-KRWDZBQOSA-N
XLogP2.62
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.44
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide?
The IUPAC name of 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide (CID 30604991) is 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide is O=C(Cc1ccc(F)cc1)NC[C@@H](c1ccsc1)N1CCOCC1.
What is the InChIKey of 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide?
The InChIKey is GKYWQXURPMZHQN-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H21FN2O2S/c19-16-3-1-14(2-4-16)11-18(22)20-12-17(15-5-10-24-13-15)21-6-8-23-9-7-21/h1-5,10,13,17H,6-9,11-12H2,(H,20,22)/t17-/m0/s1.
What are the key properties of 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide?
2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide has a molecular weight of 348.44 g/mol, XLogP of 2.62, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-[(2R)-2-morpholin-4-yl-2-thiophen-3-ylethyl]acetamide is sourced from PubChem (CID 30604991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).