N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide

C14H18FNO2 — CID 115150778

IUPACN-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide
SMILESCN(C(=O)C1CCC(O)CC1)c1ccc(F)cc1
InChIInChI=1S/C14H18FNO2/c1-16(12-6-4-11(15)5-7-12)14(18)10-2-8-13(17)9-3-10/h4-7,10,13,17H,2-3,8-9H2,1H3
InChIKeyAMKBOCRMFVXYLO-UHFFFAOYSA-N
MW251.30 g/mol
LogP2.34
Rot. Bonds2

About N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide

N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide (PubChem CID 115150778) has the molecular formula C14H18FNO2 and a molecular weight of 251.30 g/mol. Its IUPAC name is N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide
PubChem CID115150778
Molecular FormulaC14H18FNO2
Molecular Weight251.30 g/mol
Exact Mass251.13
IUPAC NameN-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide
SMILESCN(C(=O)C1CCC(O)CC1)c1ccc(F)cc1
InChIInChI=1S/C14H18FNO2/c1-16(12-6-4-11(15)5-7-12)14(18)10-2-8-13(17)9-3-10/h4-7,10,13,17H,2-3,8-9H2,1H3
InChIKeyAMKBOCRMFVXYLO-UHFFFAOYSA-N
XLogP2.34
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.30
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,4-N-bis(3,4-difluorophenyl)-1-N,4-N-dimethylcyclohexane-1,4-dicarboxamide
CID 167980780
N-(2-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide
CID 115150795
N-(4-tert-butylphenyl)-N-methylcyclopropanecarboxamide
CID 69029843
N-methyl-N-(4-methylsulfonylphenyl)cyclopropanecarboxamide
CID 136579118
4-[methyl(phenyl)carbamoyl]cyclohexane-1-carboxylic acid
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N-(4-hydroxyphenyl)-N-methylpiperidine-4-carboxamide
CID 107734326
(2S)-N-(4-fluorophenyl)-N-methylpiperidine-2-carboxamide
CID 103809324
1-(4-bromophenyl)sulfonyl-N-(4-fluorophenyl)-N-methylpiperidine-4-carboxamide
CID 100798996
N-methyl-N-(4-methylphenyl)cyclohexanecarboxamide
CID 142999335
N-[4-[acetyl(methyl)amino]phenyl]-N-methylcyclohexanecarboxamide
CID 113094811
N-methyl-N-(4-pyrrolidin-1-ylphenyl)cyclobutanecarboxamide
CID 110753175
N-(4-carbamothioylphenyl)-N-methylcycloheptanecarboxamide
CID 62969973

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide (CID 115150778) is N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide is CN(C(=O)C1CCC(O)CC1)c1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide?
The InChIKey is AMKBOCRMFVXYLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO2/c1-16(12-6-4-11(15)5-7-12)14(18)10-2-8-13(17)9-3-10/h4-7,10,13,17H,2-3,8-9H2,1H3.
What are the key properties of N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide?
N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide has a molecular weight of 251.30 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-4-hydroxy-N-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 115150778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).