(3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide

C16H17NO2S — CID 124592121

IUPAC(3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide
SMILESO=C([C@@H]1CCOC1)N(Cc1ccsc1)c1ccccc1
InChIInChI=1S/C16H17NO2S/c18-16(14-6-8-19-11-14)17(10-13-7-9-20-12-13)15-4-2-1-3-5-15/h1-5,7,9,12,14H,6,8,10-11H2/t14-/m1/s1
InChIKeyVXRZOTHLYHMCFN-CQSZACIVSA-N
MW287.38 g/mol
LogP3.32
Rot. Bonds4

About (3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide

(3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide (PubChem CID 124592121) has the molecular formula C16H17NO2S and a molecular weight of 287.38 g/mol. Its IUPAC name is (3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide
PubChem CID124592121
Molecular FormulaC16H17NO2S
Molecular Weight287.38 g/mol
Exact Mass287.10
IUPAC Name(3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide
SMILESO=C([C@@H]1CCOC1)N(Cc1ccsc1)c1ccccc1
InChIInChI=1S/C16H17NO2S/c18-16(14-6-8-19-11-14)17(10-13-7-9-20-12-13)15-4-2-1-3-5-15/h1-5,7,9,12,14H,6,8,10-11H2/t14-/m1/s1
InChIKeyVXRZOTHLYHMCFN-CQSZACIVSA-N
XLogP3.32
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.38
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide
CID 124592122
4-[phenyl(thiophen-3-ylmethyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 120674156
N-phenyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide;hydrochloride
CID 119314158
trans-(1S,3S)-3-amino-N-phenyl-N-(thiophen-3-ylmethyl)cyclopentane-1-carboxamide
CID 124591120
2-[phenyl(thiophen-3-ylmethyl)carbamoyl]cyclobutane-1-carboxylic acid
CID 120976864
N-(furan-2-ylmethyl)-N-phenyloxolane-3-carboxamide
CID 5047915
trans-(1S,2S)-2-[phenyl(thiophen-3-ylmethyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 129466411
(4S)-1-methyl-2-oxo-N-phenyl-N-(thiophen-3-ylmethyl)piperidine-4-carboxamide
CID 95331565
(3S)-N-phenyl-N-(2,2,2-trifluoroethyl)oxolane-3-carboxamide
CID 95629587
N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-phenyloxolane-3-carboxamide
CID 4603731
(3S)-N-(2-oxo-2-piperidin-1-ylethyl)-N-phenyloxolane-3-carboxamide
CID 95620326
N-ethyl-N-phenyloxane-3-carboxamide
CID 110857893

Frequently Asked Questions

What is the IUPAC name of (3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide?
The IUPAC name of (3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide (CID 124592121) is (3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide.
What is the SMILES notation for (3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide?
The canonical SMILES for (3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide is O=C([C@@H]1CCOC1)N(Cc1ccsc1)c1ccccc1.
What is the InChIKey of (3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide?
The InChIKey is VXRZOTHLYHMCFN-CQSZACIVSA-N. The full InChI is InChI=1S/C16H17NO2S/c18-16(14-6-8-19-11-14)17(10-13-7-9-20-12-13)15-4-2-1-3-5-15/h1-5,7,9,12,14H,6,8,10-11H2/t14-/m1/s1.
What are the key properties of (3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide?
(3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide has a molecular weight of 287.38 g/mol, XLogP of 3.32, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-phenyl-N-(thiophen-3-ylmethyl)oxolane-3-carboxamide is sourced from PubChem (CID 124592121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).