5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid

C16H20FNO3 — CID 110442663

IUPAC5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid
SMILESO=C(O)CCCC(=O)NC1(c2ccccc2F)CCCC1
InChIInChI=1S/C16H20FNO3/c17-13-7-2-1-6-12(13)16(10-3-4-11-16)18-14(19)8-5-9-15(20)21/h1-2,6-7H,3-5,8-11H2,(H,18,19)(H,20,21)
InChIKeyNCPAUBSRVZOIOR-UHFFFAOYSA-N
MW293.34 g/mol
LogP2.97
Rot. Bonds6

About 5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid

5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid (PubChem CID 110442663) has the molecular formula C16H20FNO3 and a molecular weight of 293.34 g/mol. Its IUPAC name is 5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid.

Molecular Properties

Compound Name5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid
PubChem CID110442663
Molecular FormulaC16H20FNO3
Molecular Weight293.34 g/mol
Exact Mass293.14
IUPAC Name5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid
SMILESO=C(O)CCCC(=O)NC1(c2ccccc2F)CCCC1
InChIInChI=1S/C16H20FNO3/c17-13-7-2-1-6-12(13)16(10-3-4-11-16)18-14(19)8-5-9-15(20)21/h1-2,6-7H,3-5,8-11H2,(H,18,19)(H,20,21)
InChIKeyNCPAUBSRVZOIOR-UHFFFAOYSA-N
XLogP2.97
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.34
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[[1-(2-fluorophenyl)cyclopropyl]amino]-4-oxobutanoic acid
CID 110465781
N-[1-(2-fluorophenyl)cyclopropyl]-4-hydroxybutanamide
CID 110480254
7-amino-N-[1-(2-fluorophenyl)cyclopropyl]heptanamide;hydrochloride
CID 119796456
4-(3,5-dimethylpyrazol-1-yl)-N-[1-(2-fluorophenyl)cyclopentyl]butanamide
CID 46963790
5-[[1-(4-fluorophenyl)cyclobutyl]amino]-5-oxopentanoic acid
CID 110442660
N-[1-(2-fluorophenyl)cyclopropyl]propanamide
CID 110477459
N-[1-(2-fluorophenyl)cyclopentyl]-3-(5-methylpyrazol-1-yl)propanamide
CID 95807137
2-fluoro-N-[1-(2-fluorophenyl)cyclopentyl]benzamide
CID 110444138
2,3,4-trifluoro-N-[1-(2-fluorophenyl)cyclopentyl]benzamide
CID 110445767
4-oxo-4-[(1-phenylcyclopentyl)amino]butanoic acid
CID 110442749
N-[1-(2-fluorophenyl)cyclopentyl]-2-(4-methoxyphenyl)acetamide
CID 110440158
4-oxo-4-[(1-phenylcyclohexyl)amino]butanoic acid
CID 110465792

Frequently Asked Questions

What is the IUPAC name of 5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid?
The IUPAC name of 5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid (CID 110442663) is 5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid.
What is the SMILES notation for 5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid?
The canonical SMILES for 5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid is O=C(O)CCCC(=O)NC1(c2ccccc2F)CCCC1.
What is the InChIKey of 5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid?
The InChIKey is NCPAUBSRVZOIOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FNO3/c17-13-7-2-1-6-12(13)16(10-3-4-11-16)18-14(19)8-5-9-15(20)21/h1-2,6-7H,3-5,8-11H2,(H,18,19)(H,20,21).
What are the key properties of 5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid?
5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid has a molecular weight of 293.34 g/mol, XLogP of 2.97, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[1-(2-fluorophenyl)cyclopentyl]amino]-5-oxopentanoic acid is sourced from PubChem (CID 110442663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).