N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide

C14H14ClNO2S — CID 99593692

IUPACN-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide
SMILESCO[C@@H](CNC(=O)c1cccs1)c1ccccc1Cl
InChIInChI=1S/C14H14ClNO2S/c1-18-12(10-5-2-3-6-11(10)15)9-16-14(17)13-7-4-8-19-13/h2-8,12H,9H2,1H3,(H,16,17)/t12-/m0/s1
InChIKeyVUDXPQHVBPZDAB-LBPRGKRZSA-N
MW295.79 g/mol
LogP3.52
Rot. Bonds5

About N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide

N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide (PubChem CID 99593692) has the molecular formula C14H14ClNO2S and a molecular weight of 295.79 g/mol. Its IUPAC name is N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide
PubChem CID99593692
Molecular FormulaC14H14ClNO2S
Molecular Weight295.79 g/mol
Exact Mass295.04
IUPAC NameN-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide
SMILESCO[C@@H](CNC(=O)c1cccs1)c1ccccc1Cl
InChIInChI=1S/C14H14ClNO2S/c1-18-12(10-5-2-3-6-11(10)15)9-16-14(17)13-7-4-8-19-13/h2-8,12H,9H2,1H3,(H,16,17)/t12-/m0/s1
InChIKeyVUDXPQHVBPZDAB-LBPRGKRZSA-N
XLogP3.52
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.79
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-chlorophenyl)-2-methoxyethyl]-4-methylthiophene-2-carboxamide
CID 90623686
4-bromo-N-[(2S)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide
CID 99876156
1-[(2S)-2-(2-chlorophenyl)-2-methoxyethyl]-3-(thiophen-2-ylmethyl)urea
CID 99601536
N-[2-(2-chlorophenyl)-2-methoxyethyl]propanamide
CID 90623661
N-[2-(2-chlorophenyl)-2-methoxyethyl]-1-thiophen-2-ylcyclopentane-1-carboxamide
CID 90623771
N-[2-(2-chlorophenyl)-2-methoxyethyl]-2-methylsulfanylbenzamide
CID 90623724
N-[(2S)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-sulfonamide
CID 99698254
N-[2-(2-chlorophenyl)-2-methoxyethyl]-2-ethylsulfanylbenzamide
CID 90623752
N-[2-(2-chlorophenyl)-2-methoxyethyl]-2-nitrobenzamide
CID 90623723
methyl 3-(2-chlorophenyl)-3-[3-(thiophene-2-carbonylamino)propanoylamino]propanoate
CID 51256884
methyl 2-amino-3-(thiophene-2-carbonylamino)propanoate
CID 22661369
N-(3-methyl-2-propan-2-ylbutyl)thiophene-2-carboxamide
CID 102908401

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide?
The IUPAC name of N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide (CID 99593692) is N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide?
The canonical SMILES for N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide is CO[C@@H](CNC(=O)c1cccs1)c1ccccc1Cl.
What is the InChIKey of N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide?
The InChIKey is VUDXPQHVBPZDAB-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H14ClNO2S/c1-18-12(10-5-2-3-6-11(10)15)9-16-14(17)13-7-4-8-19-13/h2-8,12H,9H2,1H3,(H,16,17)/t12-/m0/s1.
What are the key properties of N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide?
N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide has a molecular weight of 295.79 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-carboxamide is sourced from PubChem (CID 99593692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).