(2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide

C16H21FN2O2 — CID 27147840

IUPAC(2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide
SMILESCC(=O)N[C@H](C(=O)NCc1ccccc1F)C1CCCC1
InChIInChI=1S/C16H21FN2O2/c1-11(20)19-15(12-6-2-3-7-12)16(21)18-10-13-8-4-5-9-14(13)17/h4-5,8-9,12,15H,2-3,6-7,10H2,1H3,(H,18,21)(H,19,20)/t15-/m0/s1
InChIKeyNGWGHHYAYXWRHF-HNNXBMFYSA-N
MW292.35 g/mol
LogP2.14
Rot. Bonds5

About (2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide

(2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide (PubChem CID 27147840) has the molecular formula C16H21FN2O2 and a molecular weight of 292.35 g/mol. Its IUPAC name is (2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide.

Molecular Properties

Compound Name(2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide
PubChem CID27147840
Molecular FormulaC16H21FN2O2
Molecular Weight292.35 g/mol
Exact Mass292.16
IUPAC Name(2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide
SMILESCC(=O)N[C@H](C(=O)NCc1ccccc1F)C1CCCC1
InChIInChI=1S/C16H21FN2O2/c1-11(20)19-15(12-6-2-3-7-12)16(21)18-10-13-8-4-5-9-14(13)17/h4-5,8-9,12,15H,2-3,6-7,10H2,1H3,(H,18,21)(H,19,20)/t15-/m0/s1
InChIKeyNGWGHHYAYXWRHF-HNNXBMFYSA-N
XLogP2.14
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-acetamido-2-cyclopentyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]acetamide
CID 55981326
2-acetamido-2-cyclopentyl-N-(2-phenylethyl)acetamide
CID 51271986
2-acetamido-N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopentylacetamide
CID 51271886
2-acetamido-2-cyclopentyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 134026215
2-acetamido-2-cyclopentyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]acetamide
CID 51123302
(2R)-2-acetamido-2-cyclopentyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]acetamide
CID 52511671
2-acetamido-2-cyclopentyl-N-(2-methylphenyl)acetamide
CID 47126825
2-acetamido-N-(2-chlorophenyl)-2-cyclopentylacetamide
CID 42885299
2-acetamido-N-[2-(4-aminophenyl)ethyl]-2-cyclopentylacetamide
CID 119547727
(1R)-1-cyclopentyl-N-[(2-fluorophenyl)methyl]ethanamine
CID 81394013
benzyl (2S)-2-acetamido-2-cyclopentylacetate
CID 155326038
(2S)-2-acetamido-2-cyclopentyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]acetamide
CID 95141300

Frequently Asked Questions

What is the IUPAC name of (2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide?
The IUPAC name of (2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide (CID 27147840) is (2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide.
What is the SMILES notation for (2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide?
The canonical SMILES for (2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide is CC(=O)N[C@H](C(=O)NCc1ccccc1F)C1CCCC1.
What is the InChIKey of (2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide?
The InChIKey is NGWGHHYAYXWRHF-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H21FN2O2/c1-11(20)19-15(12-6-2-3-7-12)16(21)18-10-13-8-4-5-9-14(13)17/h4-5,8-9,12,15H,2-3,6-7,10H2,1H3,(H,18,21)(H,19,20)/t15-/m0/s1.
What are the key properties of (2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide?
(2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide has a molecular weight of 292.35 g/mol, XLogP of 2.14, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-acetamido-2-cyclopentyl-N-[(2-fluorophenyl)methyl]acetamide is sourced from PubChem (CID 27147840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).