N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide

C16H22N2O4S — CID 71921171

IUPACN-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide
SMILESCC(=O)NCc1ccc(C(=O)N2CCOC(C3CCCO3)C2)s1
InChIInChI=1S/C16H22N2O4S/c1-11(19)17-9-12-4-5-15(23-12)16(20)18-6-8-22-14(10-18)13-3-2-7-21-13/h4-5,13-14H,2-3,6-10H2,1H3,(H,17,19)
InChIKeyFVFXWVAZCYKGOT-UHFFFAOYSA-N
MW338.43 g/mol
LogP1.40
Rot. Bonds4

About N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide

N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide (PubChem CID 71921171) has the molecular formula C16H22N2O4S and a molecular weight of 338.43 g/mol. Its IUPAC name is N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide
PubChem CID71921171
Molecular FormulaC16H22N2O4S
Molecular Weight338.43 g/mol
Exact Mass338.13
IUPAC NameN-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide
SMILESCC(=O)NCc1ccc(C(=O)N2CCOC(C3CCCO3)C2)s1
InChIInChI=1S/C16H22N2O4S/c1-11(19)17-9-12-4-5-15(23-12)16(20)18-6-8-22-14(10-18)13-3-2-7-21-13/h4-5,13-14H,2-3,6-10H2,1H3,(H,17,19)
InChIKeyFVFXWVAZCYKGOT-UHFFFAOYSA-N
XLogP1.40
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[5-[3-(methylamino)piperidine-1-carbonyl]thiophen-2-yl]methyl]acetamide;hydrochloride
CID 119489478
N-[[5-[4-[(2S)-2-hydroxybutyl]piperazine-1-carbonyl]thiophen-2-yl]methyl]acetamide
CID 95613180
(2S,3aS,7aS)-1-[5-(acetamidomethyl)thiophene-2-carbonyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid
CID 124682007
(2S,3aR,7aR)-1-[5-(acetamidomethyl)thiophene-2-carbonyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid
CID 125153595
(2R)-2-[(2S)-oxolan-2-yl]-N-(2,2,2-trifluoroethyl)morpholine-4-carboxamide
CID 124513990
N-[[5-[(2R,3R)-2-(hydroxymethyl)-3-(trifluoromethyl)pyrrolidine-1-carbonyl]thiophen-2-yl]methyl]acetamide
CID 124726006
N-[[5-[2-(pyrazol-1-ylmethyl)pyrrolidine-1-carbonyl]thiophen-2-yl]methyl]acetamide
CID 56779315
2-[4-(5-ethylthiophene-2-carbonyl)morpholin-2-yl]acetic acid
CID 66421949
(2S)-2-[(2S)-oxolan-2-yl]-N-[(1S)-1-thiophen-2-ylpropyl]morpholine-4-carboxamide
CID 97096465
N-[[5-(3-propan-2-yl-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carbonyl)thiophen-2-yl]methyl]acetamide
CID 56778822
(5-ethylthiophen-2-yl)-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 107224288
(2R)-2-amino-1-[(2R)-2-[(2R)-oxolan-2-yl]morpholin-4-yl]-3-phenylpropan-1-one
CID 125152052

Frequently Asked Questions

What is the IUPAC name of N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide?
The IUPAC name of N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide (CID 71921171) is N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide.
What is the SMILES notation for N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide?
The canonical SMILES for N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide is CC(=O)NCc1ccc(C(=O)N2CCOC(C3CCCO3)C2)s1.
What is the InChIKey of N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide?
The InChIKey is FVFXWVAZCYKGOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O4S/c1-11(19)17-9-12-4-5-15(23-12)16(20)18-6-8-22-14(10-18)13-3-2-7-21-13/h4-5,13-14H,2-3,6-10H2,1H3,(H,17,19).
What are the key properties of N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide?
N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide has a molecular weight of 338.43 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[2-(oxolan-2-yl)morpholine-4-carbonyl]thiophen-2-yl]methyl]acetamide is sourced from PubChem (CID 71921171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).