N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride

C14H20ClFN2O — CID 119260253

IUPACN-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride
SMILESCl.NC1CCC(NC(=O)Cc2cccc(F)c2)CC1
InChIInChI=1S/C14H19FN2O.ClH/c15-11-3-1-2-10(8-11)9-14(18)17-13-6-4-12(16)5-7-13;/h1-3,8,12-13H,4-7,9,16H2,(H,17,18);1H
InChIKeyGDKSKBPGJNCUMK-UHFFFAOYSA-N
MW286.78 g/mol
LogP2.18
Rot. Bonds3

About N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride

N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride (PubChem CID 119260253) has the molecular formula C14H20ClFN2O and a molecular weight of 286.78 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride
PubChem CID119260253
Molecular FormulaC14H20ClFN2O
Molecular Weight286.78 g/mol
Exact Mass286.12
IUPAC NameN-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride
SMILESCl.NC1CCC(NC(=O)Cc2cccc(F)c2)CC1
InChIInChI=1S/C14H19FN2O.ClH/c15-11-3-1-2-10(8-11)9-14(18)17-13-6-4-12(16)5-7-13;/h1-3,8,12-13H,4-7,9,16H2,(H,17,18);1H
InChIKeyGDKSKBPGJNCUMK-UHFFFAOYSA-N
XLogP2.18
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.78
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorocyclohexyl)-2-(3-fluorophenyl)acetamide
CID 114296854
2-(3-fluorophenyl)-N-(4-methylcyclohexyl)acetamide
CID 78786047
4-[[2-(3-fluorophenyl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 60808861
N-(4-aminocyclohexyl)-2-(3-methylphenyl)acetamide
CID 62387693
N-(4-aminocyclohexyl)-2-(3-iodophenyl)acetamide
CID 119475463
N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide
CID 62504081
methyl 4-[[2-(3-fluorophenyl)acetyl]amino]cyclohexane-1-carboxylate
CID 115617162
1-(4-aminocyclohexyl)-2-(3-fluorophenyl)ethanone
CID 116557206
N-(4-aminocyclohexyl)-3-fluorobenzamide
CID 43653117
[2-(cyclopropylcarbamoylamino)-2-oxoethyl] 2-(3-fluorophenyl)acetate
CID 8589718
N-(4-aminocyclohexyl)-2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]acetamide
CID 119474502
N-(1,1-dioxothiolan-3-yl)-2-(3-fluorophenyl)acetamide
CID 51240347

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride?
The IUPAC name of N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride (CID 119260253) is N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride?
The canonical SMILES for N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride is Cl.NC1CCC(NC(=O)Cc2cccc(F)c2)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride?
The InChIKey is GDKSKBPGJNCUMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O.ClH/c15-11-3-1-2-10(8-11)9-14(18)17-13-6-4-12(16)5-7-13;/h1-3,8,12-13H,4-7,9,16H2,(H,17,18);1H.
What are the key properties of N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride?
N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride has a molecular weight of 286.78 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride is sourced from PubChem (CID 119260253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).