N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide

C14H17FN2O2 — CID 772128

IUPACN-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide
SMILESO=C(CNC(=O)C1CCCC1)Nc1cccc(F)c1
InChIInChI=1S/C14H17FN2O2/c15-11-6-3-7-12(8-11)17-13(18)9-16-14(19)10-4-1-2-5-10/h3,6-8,10H,1-2,4-5,9H2,(H,16,19)(H,17,18)
InChIKeyVIZQZSMAMATSNQ-UHFFFAOYSA-N
MW264.30 g/mol
LogP2.07
Rot. Bonds4

About N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide

N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide (PubChem CID 772128) has the molecular formula C14H17FN2O2 and a molecular weight of 264.30 g/mol. Its IUPAC name is N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide
PubChem CID772128
Molecular FormulaC14H17FN2O2
Molecular Weight264.30 g/mol
Exact Mass264.13
IUPAC NameN-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide
SMILESO=C(CNC(=O)C1CCCC1)Nc1cccc(F)c1
InChIInChI=1S/C14H17FN2O2/c15-11-6-3-7-12(8-11)17-13(18)9-16-14(19)10-4-1-2-5-10/h3,6-8,10H,1-2,4-5,9H2,(H,16,19)(H,17,18)
InChIKeyVIZQZSMAMATSNQ-UHFFFAOYSA-N
XLogP2.07
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(3-fluoroanilino)-2-oxoethyl]cyclobutanecarboxamide
CID 772134
N-[2-(3-fluoroanilino)-2-oxoethyl]piperidine-4-carboxamide
CID 119308743
N-[2-(3-fluoroanilino)-2-oxoethyl]piperidine-3-carboxamide;hydrochloride
CID 119308754
N-[2-[[2-(3-fluoroanilino)-2-oxoethyl]amino]ethyl]cyclopropanecarboxamide
CID 115571346
N-[2-[4-[2-(3-fluoroanilino)-2-oxoethyl]piperazin-1-yl]-2-oxoethyl]cyclohexanecarboxamide
CID 9020209
N-[2-(3-fluoroanilino)-2-oxoethyl]oxolane-2-carboxamide
CID 49336024
N-[2-(3-fluoroanilino)-2-oxoethyl]pyrrolidine-2-carboxamide
CID 119308747
N-[2-(3-chloroanilino)-2-oxoethyl]cyclobutanecarboxamide
CID 112997859
(2S,4S)-N-[2-(3-fluoroanilino)-2-oxoethyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120627706
N-[3-[[2-[[2-(3-fluorophenyl)acetyl]amino]acetyl]amino]phenyl]cyclopropanecarboxamide
CID 55828959
N-[2-(3-fluoroanilino)-2-oxoethyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide;hydrochloride
CID 119308736
methyl 3-[[2-(cyclobutanecarbonylamino)acetyl]amino]benzoate
CID 112999895

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide?
The IUPAC name of N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide (CID 772128) is N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide?
The canonical SMILES for N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide is O=C(CNC(=O)C1CCCC1)Nc1cccc(F)c1.
What is the InChIKey of N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide?
The InChIKey is VIZQZSMAMATSNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O2/c15-11-6-3-7-12(8-11)17-13(18)9-16-14(19)10-4-1-2-5-10/h3,6-8,10H,1-2,4-5,9H2,(H,16,19)(H,17,18).
What are the key properties of N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide?
N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide has a molecular weight of 264.30 g/mol, XLogP of 2.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-fluoroanilino)-2-oxoethyl]cyclopentanecarboxamide is sourced from PubChem (CID 772128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).