N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide

C19H23NO2S — CID 42960691

IUPACN-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)NC(c2cccs2)C2CCCC2)cc1
InChIInChI=1S/C19H23NO2S/c1-22-16-10-8-14(9-11-16)13-18(21)20-19(15-5-2-3-6-15)17-7-4-12-23-17/h4,7-12,15,19H,2-3,5-6,13H2,1H3,(H,20,21)
InChIKeyXRAYFQJMVAEJQA-UHFFFAOYSA-N
MW329.47 g/mol
LogP4.35
Rot. Bonds6

About N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide

N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide (PubChem CID 42960691) has the molecular formula C19H23NO2S and a molecular weight of 329.47 g/mol. Its IUPAC name is N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide
PubChem CID42960691
Molecular FormulaC19H23NO2S
Molecular Weight329.47 g/mol
Exact Mass329.14
IUPAC NameN-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)NC(c2cccs2)C2CCCC2)cc1
InChIInChI=1S/C19H23NO2S/c1-22-16-10-8-14(9-11-16)13-18(21)20-19(15-5-2-3-6-15)17-7-4-12-23-17/h4,7-12,15,19H,2-3,5-6,13H2,1H3,(H,20,21)
InChIKeyXRAYFQJMVAEJQA-UHFFFAOYSA-N
XLogP4.35
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.47
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclopentyl(phenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 2964253
2-(cyclopentylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide
CID 60847966
2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide
CID 78987130
N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxypropanamide
CID 47307968
N-[cyclopentyl(thiophen-2-yl)methyl]-3-phenoxypropanamide
CID 47031450
1-[(R)-cyclopentyl(thiophen-2-yl)methyl]-3-methylurea
CID 94152755
N-[cyclopentyl(thiophen-2-yl)methyl]-3-(2-hydroxyphenyl)propanamide
CID 47031446
1-[cyclopentyl(thiophen-2-yl)methyl]-3-[4-(2-methoxyethoxy)phenyl]urea
CID 55697423
N-[2-[[cyclopentyl(thiophen-2-yl)methyl]amino]-2-oxoethyl]thiophene-2-carboxamide
CID 42960858
N-[(R)-cyclopentyl(thiophen-2-yl)methyl]thiophene-2-carboxamide
CID 39032304
2-(4-methoxyphenyl)-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-2-ylethyl]acetamide
CID 51179491
N-[(2R)-2-(azepan-1-yl)-2-thiophen-2-ylethyl]-2-(4-methoxyphenyl)acetamide
CID 35042423

Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide?
The IUPAC name of N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide (CID 42960691) is N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide is COc1ccc(CC(=O)NC(c2cccs2)C2CCCC2)cc1.
What is the InChIKey of N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide?
The InChIKey is XRAYFQJMVAEJQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2S/c1-22-16-10-8-14(9-11-16)13-18(21)20-19(15-5-2-3-6-15)17-7-4-12-23-17/h4,7-12,15,19H,2-3,5-6,13H2,1H3,(H,20,21).
What are the key properties of N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide?
N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide has a molecular weight of 329.47 g/mol, XLogP of 4.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 42960691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).