N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide

C14H18FNO2S — CID 95169396

IUPACN-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide
SMILESO=C(C[S@](=O)Cc1cccc(F)c1)NC1CCCC1
InChIInChI=1S/C14H18FNO2S/c15-12-5-3-4-11(8-12)9-19(18)10-14(17)16-13-6-1-2-7-13/h3-5,8,13H,1-2,6-7,9-10H2,(H,16,17)/t19-/m1/s1
InChIKeyPEJNYROASZPFMC-LJQANCHMSA-N
MW283.37 g/mol
LogP2.13
Rot. Bonds5

About N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide

N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide (PubChem CID 95169396) has the molecular formula C14H18FNO2S and a molecular weight of 283.37 g/mol. Its IUPAC name is N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide
PubChem CID95169396
Molecular FormulaC14H18FNO2S
Molecular Weight283.37 g/mol
Exact Mass283.10
IUPAC NameN-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide
SMILESO=C(C[S@](=O)Cc1cccc(F)c1)NC1CCCC1
InChIInChI=1S/C14H18FNO2S/c15-12-5-3-4-11(8-12)9-19(18)10-14(17)16-13-6-1-2-7-13/h3-5,8,13H,1-2,6-7,9-10H2,(H,16,17)/t19-/m1/s1
InChIKeyPEJNYROASZPFMC-LJQANCHMSA-N
XLogP2.13
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-2-[(S)-[3-(trifluoromethyl)phenyl]methylsulfinyl]acetamide
CID 95169267
N-(cyclopropylmethyl)-2-[(3-fluorophenyl)methylsulfinyl]acetamide
CID 56827603
N-cyclohexyl-2-[(R)-[3-(dimethylsulfamoyl)phenyl]methylsulfinyl]acetamide
CID 95763029
N-cyclopentyl-2-[(S)-(5-fluoro-2-methoxyphenyl)methylsulfinyl]acetamide
CID 96548269
N-(4-chlorocyclohexyl)-2-(3-fluorophenyl)acetamide
CID 114296854
2-[(R)-(3-fluorophenyl)methylsulfinyl]-N-(4-methylphenyl)acetamide
CID 95169391
2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide
CID 78786047
N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride
CID 119260253
4-[[2-(3-fluorophenyl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 60808861
2-(3-fluorophenyl)-N-piperidin-3-ylacetamide
CID 18071271
N-cyclopentyl-2-[(R)-(2,5-dimethylphenyl)methylsulfinyl]acetamide
CID 95169060
methyl 4-[[2-(3-fluorophenyl)acetyl]amino]cyclohexane-1-carboxylate
CID 115617162

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide?
The IUPAC name of N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide (CID 95169396) is N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide?
The canonical SMILES for N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide is O=C(C[S@](=O)Cc1cccc(F)c1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide?
The InChIKey is PEJNYROASZPFMC-LJQANCHMSA-N. The full InChI is InChI=1S/C14H18FNO2S/c15-12-5-3-4-11(8-12)9-19(18)10-14(17)16-13-6-1-2-7-13/h3-5,8,13H,1-2,6-7,9-10H2,(H,16,17)/t19-/m1/s1.
What are the key properties of N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide?
N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide has a molecular weight of 283.37 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[(R)-(3-fluorophenyl)methylsulfinyl]acetamide is sourced from PubChem (CID 95169396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).