(2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide

C17H19NO2S — CID 95629116

IUPAC(2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide
SMILESO=C(N[C@@H](Cc1ccccc1)c1cccs1)[C@H]1CCCO1
InChIInChI=1S/C17H19NO2S/c19-17(15-8-4-10-20-15)18-14(16-9-5-11-21-16)12-13-6-2-1-3-7-13/h1-3,5-7,9,11,14-15H,4,8,10,12H2,(H,18,19)/t14-,15+/m0/s1
InChIKeyFKZMZRCHSFSZFN-LSDHHAIUSA-N
MW301.41 g/mol
LogP3.33
Rot. Bonds5

About (2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide

(2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide (PubChem CID 95629116) has the molecular formula C17H19NO2S and a molecular weight of 301.41 g/mol. Its IUPAC name is (2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide
PubChem CID95629116
Molecular FormulaC17H19NO2S
Molecular Weight301.41 g/mol
Exact Mass301.11
IUPAC Name(2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide
SMILESO=C(N[C@@H](Cc1ccccc1)c1cccs1)[C@H]1CCCO1
InChIInChI=1S/C17H19NO2S/c19-17(15-8-4-10-20-15)18-14(16-9-5-11-21-16)12-13-6-2-1-3-7-13/h1-3,5-7,9,11,14-15H,4,8,10,12H2,(H,18,19)/t14-,15+/m0/s1
InChIKeyFKZMZRCHSFSZFN-LSDHHAIUSA-N
XLogP3.33
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.41
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-[(S)-phenyl(thiophen-2-yl)methyl]oxolane-2-carboxamide
CID 38010742
(2R)-N-[(1R)-2-methyl-1-thiophen-2-ylpropyl]oxolane-2-carboxamide
CID 39968344
2-(oxane-2-carbonylamino)-2-thiophen-2-ylacetic acid
CID 115284229
(2S)-N-[(2S)-2-[[(2R)-oxolane-2-carbonyl]amino]-3-phenylpropyl]oxolane-2-carboxamide
CID 100849813
N-(2-phenyl-1-thiophen-2-ylethyl)pyrrolidine-3-carboxamide
CID 119794217
(2S)-2-(oxane-2-carbonylamino)-3-phenylpropanoic acid
CID 62213678
N-[(1S)-2-amino-1-phenylethyl]oxolane-2-carboxamide
CID 57091313
N-(2-amino-1-phenylethyl)oxolane-2-carboxamide
CID 55242926
(2R)-N-[3-[[[(1R)-1-thiophen-2-ylpropyl]amino]methyl]phenyl]oxolane-2-carboxamide
CID 97230592
methyl (2S,3R)-2-benzyl-3-[[(2S)-oxolane-2-carbonyl]amino]butanoate
CID 129432504
2-(oxolane-2-carbonylamino)-3-pyridin-4-ylpropanoic acid
CID 136551315
N-[2-(azepan-1-yl)-2-thiophen-2-ylethyl]oxolane-2-carboxamide
CID 112504779

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide?
The IUPAC name of (2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide (CID 95629116) is (2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide is O=C(N[C@@H](Cc1ccccc1)c1cccs1)[C@H]1CCCO1.
What is the InChIKey of (2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide?
The InChIKey is FKZMZRCHSFSZFN-LSDHHAIUSA-N. The full InChI is InChI=1S/C17H19NO2S/c19-17(15-8-4-10-20-15)18-14(16-9-5-11-21-16)12-13-6-2-1-3-7-13/h1-3,5-7,9,11,14-15H,4,8,10,12H2,(H,18,19)/t14-,15+/m0/s1.
What are the key properties of (2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide?
(2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide has a molecular weight of 301.41 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1S)-2-phenyl-1-thiophen-2-ylethyl]oxolane-2-carboxamide is sourced from PubChem (CID 95629116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).