N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride

C14H19ClFN3O2 — CID 119278283

IUPACN-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride
SMILESCC(=O)Nc1cc(NC(=O)C2CCNCC2)ccc1F.Cl
InChIInChI=1S/C14H18FN3O2.ClH/c1-9(19)17-13-8-11(2-3-12(13)15)18-14(20)10-4-6-16-7-5-10;/h2-3,8,10,16H,4-7H2,1H3,(H,17,19)(H,18,20);1H
InChIKeyBFPXIAKXSCYHOE-UHFFFAOYSA-N
MW315.78 g/mol
LogP2.14
Rot. Bonds3

About N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride

N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride (PubChem CID 119278283) has the molecular formula C14H19ClFN3O2 and a molecular weight of 315.78 g/mol. Its IUPAC name is N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride
PubChem CID119278283
Molecular FormulaC14H19ClFN3O2
Molecular Weight315.78 g/mol
Exact Mass315.11
IUPAC NameN-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride
SMILESCC(=O)Nc1cc(NC(=O)C2CCNCC2)ccc1F.Cl
InChIInChI=1S/C14H18FN3O2.ClH/c1-9(19)17-13-8-11(2-3-12(13)15)18-14(20)10-4-6-16-7-5-10;/h2-3,8,10,16H,4-7H2,1H3,(H,17,19)(H,18,20);1H
InChIKeyBFPXIAKXSCYHOE-UHFFFAOYSA-N
XLogP2.14
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.78
LogP ≤ 52.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-acetamido-2-fluorophenyl)piperidine-4-carboxamide;hydrochloride
CID 119279496
N-[3-(cyclohexanecarbonylamino)-4-fluorophenyl]piperidine-4-carboxamide;hydrochloride
CID 119282876
N-(5-acetamido-2-fluorophenyl)cyclobutanecarboxamide
CID 46429163
methyl 2-fluoro-5-(piperidine-4-carbonylamino)benzoate
CID 43707540
N-(5-acetamido-2-chlorophenyl)piperidine-4-carboxamide
CID 119280735
N-[2-fluoro-5-(3-piperidin-4-ylbutanoylamino)phenyl]cyclohexanecarboxamide
CID 119711633
N-(3-acetamido-4-fluorophenyl)-2-aminocyclohexane-1-carboxamide
CID 64822591
N-(5-acetamido-2-fluorophenyl)-3-aminocyclohexane-1-carboxamide;hydrochloride
CID 119705036
N-(3-acetamido-4-fluorophenyl)-3-aminobicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119702824
N-[5-(cyclopropylcarbamoylamino)-2-fluorophenyl]acetamide
CID 47162368
N-(4-acetamido-3-methoxyphenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119713245
N-(3-acetamido-4-fluorophenyl)-2-piperazin-1-ylacetamide
CID 60928545

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride (CID 119278283) is N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride is CC(=O)Nc1cc(NC(=O)C2CCNCC2)ccc1F.Cl.
What is the InChIKey of N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is BFPXIAKXSCYHOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN3O2.ClH/c1-9(19)17-13-8-11(2-3-12(13)15)18-14(20)10-4-6-16-7-5-10;/h2-3,8,10,16H,4-7H2,1H3,(H,17,19)(H,18,20);1H.
What are the key properties of N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride?
N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride has a molecular weight of 315.78 g/mol, XLogP of 2.14, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamido-4-fluorophenyl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119278283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).