1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid

C14H16FNO3 — CID 43329539

IUPAC1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid
SMILESO=C(Cc1ccccc1F)NC1(C(=O)O)CCCC1
InChIInChI=1S/C14H16FNO3/c15-11-6-2-1-5-10(11)9-12(17)16-14(13(18)19)7-3-4-8-14/h1-2,5-6H,3-4,7-9H2,(H,16,17)(H,18,19)
InChIKeyUQTCVVKFBGZVDI-UHFFFAOYSA-N
MW265.28 g/mol
LogP1.88
Rot. Bonds4

About 1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid

1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid (PubChem CID 43329539) has the molecular formula C14H16FNO3 and a molecular weight of 265.28 g/mol. Its IUPAC name is 1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid
PubChem CID43329539
Molecular FormulaC14H16FNO3
Molecular Weight265.28 g/mol
Exact Mass265.11
IUPAC Name1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid
SMILESO=C(Cc1ccccc1F)NC1(C(=O)O)CCCC1
InChIInChI=1S/C14H16FNO3/c15-11-6-2-1-5-10(11)9-12(17)16-14(13(18)19)7-3-4-8-14/h1-2,5-6H,3-4,7-9H2,(H,16,17)(H,18,19)
InChIKeyUQTCVVKFBGZVDI-UHFFFAOYSA-N
XLogP1.88
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[2-(2,3-difluorophenyl)acetyl]amino]cycloheptane-1-carboxylic acid
CID 120538773
N-(1-carbamothioylcycloheptyl)-2-(2-fluorophenyl)acetamide
CID 61119179
1-[(2-fluorophenyl)methylcarbamoylamino]cyclobutane-1-carboxylic acid
CID 81162721
1-[[3-(2-fluorophenyl)-2-methylpropanoyl]amino]cyclohexane-1-carboxylic acid
CID 119168113
1-[[2-(2-hydroxyphenyl)acetyl]amino]cyclopropane-1-carboxylic acid
CID 80740936
1-[[2-(3-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 43329516
1-[[2-[2-(trifluoromethyl)phenyl]acetyl]amino]cyclopropane-1-carboxylic acid
CID 75483399
1-[[2-(2-nitrophenyl)acetyl]amino]cyclobutane-1-carboxylic acid
CID 81158336
1-[[2-(5-fluoro-2-methoxyphenyl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 120666403
1-[(2,6-difluorobenzoyl)amino]cyclopentane-1-carboxylic acid
CID 43162964
1-[[2-[(2-phenylacetyl)amino]acetyl]amino]cyclopentane-1-carboxylic acid
CID 119176363
1-[2-(2-fluorophenoxy)butanoylamino]cyclohexane-1-carboxylic acid
CID 119168045

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid (CID 43329539) is 1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid is O=C(Cc1ccccc1F)NC1(C(=O)O)CCCC1.
What is the InChIKey of 1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid?
The InChIKey is UQTCVVKFBGZVDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNO3/c15-11-6-2-1-5-10(11)9-12(17)16-14(13(18)19)7-3-4-8-14/h1-2,5-6H,3-4,7-9H2,(H,16,17)(H,18,19).
What are the key properties of 1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid?
1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid has a molecular weight of 265.28 g/mol, XLogP of 1.88, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(2-fluorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 43329539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).