2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide

C17H26N2O3S — CID 94083341

IUPAC2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide
SMILESCc1cc(C(=O)NC[C@H]([C@@H]2CCOC2)N2CCOCC2)c(C)s1
InChIInChI=1S/C17H26N2O3S/c1-12-9-15(13(2)23-12)17(20)18-10-16(14-3-6-22-11-14)19-4-7-21-8-5-19/h9,14,16H,3-8,10-11H2,1-2H3,(H,18,20)/t14-,16-/m1/s1
InChIKeyPUGFYGMUTZISBC-GDBMZVCRSA-N
MW338.47 g/mol
LogP1.83
Rot. Bonds5

About 2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide

2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide (PubChem CID 94083341) has the molecular formula C17H26N2O3S and a molecular weight of 338.47 g/mol. Its IUPAC name is 2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide
PubChem CID94083341
Molecular FormulaC17H26N2O3S
Molecular Weight338.47 g/mol
Exact Mass338.17
IUPAC Name2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide
SMILESCc1cc(C(=O)NC[C@H]([C@@H]2CCOC2)N2CCOCC2)c(C)s1
InChIInChI=1S/C17H26N2O3S/c1-12-9-15(13(2)23-12)17(20)18-10-16(14-3-6-22-11-14)19-4-7-21-8-5-19/h9,14,16H,3-8,10-11H2,1-2H3,(H,18,20)/t14-,16-/m1/s1
InChIKeyPUGFYGMUTZISBC-GDBMZVCRSA-N
XLogP1.83
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.47
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide with MolForge

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Related Compounds

5-methyl-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-1,2-oxazole-3-carboxamide
CID 94022952
1,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide
CID 94021725
1,5-dimethyl-N-[(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]pyrazole-4-carboxamide
CID 94021723
5-ethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-2-carboxamide
CID 94021730
2-methylsulfonyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]benzamide
CID 55642293
2-(4-methylphenyl)-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]acetamide
CID 94150138
N-[(2S)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethyl]thiophene-2-carboxamide
CID 94083431
6-cyclopropyl-3-methyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide
CID 78858824
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,5-dimethyl-N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]pyrrole-3-carboxamide
CID 55642248
2-methoxy-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]pyridine-3-carboxamide
CID 94024269
1-[(3-methylthiophen-2-yl)methyl]-3-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]urea
CID 55792498
(2S)-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-2-phenylbutanamide
CID 94150246

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide?
The IUPAC name of 2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide (CID 94083341) is 2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide.
What is the SMILES notation for 2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide?
The canonical SMILES for 2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide is Cc1cc(C(=O)NC[C@H]([C@@H]2CCOC2)N2CCOCC2)c(C)s1.
What is the InChIKey of 2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide?
The InChIKey is PUGFYGMUTZISBC-GDBMZVCRSA-N. The full InChI is InChI=1S/C17H26N2O3S/c1-12-9-15(13(2)23-12)17(20)18-10-16(14-3-6-22-11-14)19-4-7-21-8-5-19/h9,14,16H,3-8,10-11H2,1-2H3,(H,18,20)/t14-,16-/m1/s1.
What are the key properties of 2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide?
2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide has a molecular weight of 338.47 g/mol, XLogP of 1.83, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]thiophene-3-carboxamide is sourced from PubChem (CID 94083341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).