N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide

C11H15NO2S — CID 35235171

IUPACN-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide
SMILESC[C@@H](NC(=O)c1ccsc1)[C@H]1CCCO1
InChIInChI=1S/C11H15NO2S/c1-8(10-3-2-5-14-10)12-11(13)9-4-6-15-7-9/h4,6-8,10H,2-3,5H2,1H3,(H,12,13)/t8-,10-/m1/s1
InChIKeySFJKNDIVYVURHW-PSASIEDQSA-N
MW225.31 g/mol
LogP2.05
Rot. Bonds3

About N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide

N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide (PubChem CID 35235171) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide
PubChem CID35235171
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC NameN-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide
SMILESC[C@@H](NC(=O)c1ccsc1)[C@H]1CCCO1
InChIInChI=1S/C11H15NO2S/c1-8(10-3-2-5-14-10)12-11(13)9-4-6-15-7-9/h4,6-8,10H,2-3,5H2,1H3,(H,12,13)/t8-,10-/m1/s1
InChIKeySFJKNDIVYVURHW-PSASIEDQSA-N
XLogP2.05
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]-2-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]thiophene-2,5-dicarboxamide
CID 98786018
4-methyl-N-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]benzamide
CID 27232652
N-[1-(oxolan-2-yl)ethyl]-4-propan-2-ylbenzamide
CID 6468560
5-methyl-N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]thiophene-3-carboxamide
CID 1247088
N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]-5-propan-2-ylthiophene-3-carboxamide
CID 29037742
3,5-dimethyl-N-[(1R)-1-[(2S)-oxolan-2-yl]ethyl]benzamide
CID 27233431
methyl 5-[[(1S)-1-[(2R)-oxolan-2-yl]ethyl]carbamoyl]thiophene-2-carboxylate
CID 35252676
4-(chloromethyl)-N-[1-(oxolan-2-yl)ethyl]benzamide
CID 43533877
(2S)-N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]-2-thiophen-3-ylpyrrolidine-1-carboxamide
CID 100836452
N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]-4-phenoxybenzamide
CID 35273707
N-[1-(oxolan-2-yl)ethyl]-5-propylthiophene-3-carboxamide
CID 6469294
1-[(2S)-2-(dimethylamino)-2-thiophen-3-ylethyl]-3-[(1S)-1-[(2R)-oxolan-2-yl]ethyl]urea
CID 124728838

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide?
The IUPAC name of N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide (CID 35235171) is N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide.
What is the SMILES notation for N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide?
The canonical SMILES for N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide is C[C@@H](NC(=O)c1ccsc1)[C@H]1CCCO1.
What is the InChIKey of N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide?
The InChIKey is SFJKNDIVYVURHW-PSASIEDQSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-8(10-3-2-5-14-10)12-11(13)9-4-6-15-7-9/h4,6-8,10H,2-3,5H2,1H3,(H,12,13)/t8-,10-/m1/s1.
What are the key properties of N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide?
N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide has a molecular weight of 225.31 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-[(2R)-oxolan-2-yl]ethyl]thiophene-3-carboxamide is sourced from PubChem (CID 35235171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).