N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide

C15H19FN2O2 — CID 113092924

IUPACN-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide
SMILESCC(=O)Nc1ccc(F)cc1NC(=O)C1CCCCC1
InChIInChI=1S/C15H19FN2O2/c1-10(19)17-13-8-7-12(16)9-14(13)18-15(20)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,17,19)(H,18,20)
InChIKeyQGVQTXCKEZZEPP-UHFFFAOYSA-N
MW278.33 g/mol
LogP3.30
Rot. Bonds3

About N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide

N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide (PubChem CID 113092924) has the molecular formula C15H19FN2O2 and a molecular weight of 278.33 g/mol. Its IUPAC name is N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide
PubChem CID113092924
Molecular FormulaC15H19FN2O2
Molecular Weight278.33 g/mol
Exact Mass278.14
IUPAC NameN-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide
SMILESCC(=O)Nc1ccc(F)cc1NC(=O)C1CCCCC1
InChIInChI=1S/C15H19FN2O2/c1-10(19)17-13-8-7-12(16)9-14(13)18-15(20)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,17,19)(H,18,20)
InChIKeyQGVQTXCKEZZEPP-UHFFFAOYSA-N
XLogP3.30
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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N-[5-fluoro-2-(methanesulfonamido)phenyl]cyclobutanecarboxamide
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N-(4-fluoro-2-methylphenyl)cyclobutanecarboxamide
CID 17069288
N-[2-(dimethylamino)-5-fluorophenyl]cyclobutanecarboxamide
CID 113092522
1-N,4-N-bis(2,4-difluorophenyl)cyclohexane-1,4-dicarboxamide
CID 26722049
N-(5-fluoro-2-nitrophenyl)cyclopentanecarboxamide
CID 110461317
N-[2-(3-aminopropanoylamino)-4-fluorophenyl]cyclopropanecarboxamide
CID 82034301
N-(5-fluoro-2-pyrrolidin-1-ylphenyl)cyclobutanecarboxamide
CID 113092391
N-[4-fluoro-2-[(E)-N'-hydroxycarbamimidoyl]phenyl]cyclopentanecarboxamide
CID 82685115
N-[2-(3-aminoprop-1-ynyl)-4-fluorophenyl]cycloheptanecarboxamide
CID 62589276
1-[2-(cyclohexanecarbonylamino)anilino]ethylidene-dimethylazanium
CID 21440518
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CID 837694

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide?
The IUPAC name of N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide (CID 113092924) is N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide.
What is the SMILES notation for N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide?
The canonical SMILES for N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide is CC(=O)Nc1ccc(F)cc1NC(=O)C1CCCCC1.
What is the InChIKey of N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide?
The InChIKey is QGVQTXCKEZZEPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O2/c1-10(19)17-13-8-7-12(16)9-14(13)18-15(20)11-5-3-2-4-6-11/h7-9,11H,2-6H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide?
N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide has a molecular weight of 278.33 g/mol, XLogP of 3.30, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamido-5-fluorophenyl)cyclohexanecarboxamide is sourced from PubChem (CID 113092924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).