N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide

C19H23NO3S — CID 19486863

IUPACN-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide
SMILESCCOc1ccccc1OCc1csc(C(=O)NC2CCCC2)c1
InChIInChI=1S/C19H23NO3S/c1-2-22-16-9-5-6-10-17(16)23-12-14-11-18(24-13-14)19(21)20-15-7-3-4-8-15/h5-6,9-11,13,15H,2-4,7-8,12H2,1H3,(H,20,21)
InChIKeyMPDISNXMPGUNNN-UHFFFAOYSA-N
MW345.46 g/mol
LogP4.40
Rot. Bonds7

About N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide

N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide (PubChem CID 19486863) has the molecular formula C19H23NO3S and a molecular weight of 345.46 g/mol. Its IUPAC name is N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide
PubChem CID19486863
Molecular FormulaC19H23NO3S
Molecular Weight345.46 g/mol
Exact Mass345.14
IUPAC NameN-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide
SMILESCCOc1ccccc1OCc1csc(C(=O)NC2CCCC2)c1
InChIInChI=1S/C19H23NO3S/c1-2-22-16-9-5-6-10-17(16)23-12-14-11-18(24-13-14)19(21)20-15-7-3-4-8-15/h5-6,9-11,13,15H,2-4,7-8,12H2,1H3,(H,20,21)
InChIKeyMPDISNXMPGUNNN-UHFFFAOYSA-N
XLogP4.40
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.46
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-4-[(2,5-dimethylphenoxy)methyl]thiophene-2-carboxamide
CID 19471562
4-[(4-chloro-2-methylphenoxy)methyl]-N-cyclopentylthiophene-2-carboxamide
CID 19486629
N-cycloheptyl-4-[(4-methoxyphenoxy)methyl]thiophene-2-carboxamide
CID 19499174
N-cyclohexyl-4-[(4-methoxyphenoxy)methyl]thiophene-2-carboxamide
CID 19499225
4-[(3-chlorophenoxy)methyl]-N-cycloheptylthiophene-2-carboxamide
CID 19505128
N-(3,5-dimethylphenyl)-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide
CID 19486859
N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-4-[(2-methylphenoxy)methyl]thiophene-2-carboxamide
CID 19498856
4-[(4-chlorophenoxy)methyl]-N-cycloheptylthiophene-2-carboxamide
CID 19503276
4-[(4-chlorophenoxy)methyl]-N-cyclopropylthiophene-2-carboxamide
CID 19503287
N-cyclopentyl-2,6-diethoxybenzamide
CID 118034872
N-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-4-(phenoxymethyl)thiophene-2-carboxamide
CID 19490992
4-[(3-chlorophenoxy)methyl]-N-(1-methylpiperidin-4-yl)thiophene-2-carboxamide
CID 19505245

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide?
The IUPAC name of N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide (CID 19486863) is N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide?
The canonical SMILES for N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide is CCOc1ccccc1OCc1csc(C(=O)NC2CCCC2)c1.
What is the InChIKey of N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide?
The InChIKey is MPDISNXMPGUNNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3S/c1-2-22-16-9-5-6-10-17(16)23-12-14-11-18(24-13-14)19(21)20-15-7-3-4-8-15/h5-6,9-11,13,15H,2-4,7-8,12H2,1H3,(H,20,21).
What are the key properties of N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide?
N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide has a molecular weight of 345.46 g/mol, XLogP of 4.40, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-[(2-ethoxyphenoxy)methyl]thiophene-2-carboxamide is sourced from PubChem (CID 19486863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).