[4-(piperidine-1-carbonylamino)phenyl] hypofluorite

C12H15FN2O2 — CID 71166566

IUPAC[4-(piperidine-1-carbonylamino)phenyl] hypofluorite
SMILESO=C(Nc1ccc(OF)cc1)N1CCCCC1
InChIInChI=1S/C12H15FN2O2/c13-17-11-6-4-10(5-7-11)14-12(16)15-8-2-1-3-9-15/h4-7H,1-3,8-9H2,(H,14,16)
InChIKeyFSDICZSUFMFUJX-UHFFFAOYSA-N
MW238.26 g/mol
LogP2.97
Rot. Bonds2

About [4-(piperidine-1-carbonylamino)phenyl] hypofluorite

[4-(piperidine-1-carbonylamino)phenyl] hypofluorite (PubChem CID 71166566) has the molecular formula C12H15FN2O2 and a molecular weight of 238.26 g/mol. Its IUPAC name is [4-(piperidine-1-carbonylamino)phenyl] hypofluorite.

Molecular Properties

Compound Name[4-(piperidine-1-carbonylamino)phenyl] hypofluorite
PubChem CID71166566
Molecular FormulaC12H15FN2O2
Molecular Weight238.26 g/mol
Exact Mass238.11
IUPAC Name[4-(piperidine-1-carbonylamino)phenyl] hypofluorite
SMILESO=C(Nc1ccc(OF)cc1)N1CCCCC1
InChIInChI=1S/C12H15FN2O2/c13-17-11-6-4-10(5-7-11)14-12(16)15-8-2-1-3-9-15/h4-7H,1-3,8-9H2,(H,14,16)
InChIKeyFSDICZSUFMFUJX-UHFFFAOYSA-N
XLogP2.97
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.26
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(difluoromethoxy)phenyl]pyrrolidine-1-carboxamide
CID 47162409
N-[4-(trifluoromethoxy)phenyl]pyrrolidine-1-carboxamide
CID 47193651
N-(4-bromophenyl)azocane-1-carboxamide
CID 3245808
N-(4-butoxyphenyl)piperidine-1-carboxamide
CID 3042761
2-[4-(pyrrolidine-1-carbonylamino)phenoxy]acetic acid
CID 63772208
N-(4-methoxyphenyl)-1,6-diazacycloundecane-1-carboxamide
CID 144843106
N-(4-pyrrolidin-1-ylphenyl)azepane-1-carboxamide
CID 108991070
4-(pyrrolidine-1-carbonylamino)benzoic acid
CID 39732858
N-(4-cyanophenyl)piperidine-1-carboxamide
CID 89462027
N-(3,4-difluorophenyl)piperidine-1-carboxamide
CID 90728139
N-[4-(2-hydroxyethyl)phenyl]azepane-1-carboxamide
CID 79152025
N-(4-sulfamoylphenyl)azocane-1-carboxamide
CID 17414007

Frequently Asked Questions

What is the IUPAC name of [4-(piperidine-1-carbonylamino)phenyl] hypofluorite?
The IUPAC name of [4-(piperidine-1-carbonylamino)phenyl] hypofluorite (CID 71166566) is [4-(piperidine-1-carbonylamino)phenyl] hypofluorite.
What is the SMILES notation for [4-(piperidine-1-carbonylamino)phenyl] hypofluorite?
The canonical SMILES for [4-(piperidine-1-carbonylamino)phenyl] hypofluorite is O=C(Nc1ccc(OF)cc1)N1CCCCC1.
What is the InChIKey of [4-(piperidine-1-carbonylamino)phenyl] hypofluorite?
The InChIKey is FSDICZSUFMFUJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN2O2/c13-17-11-6-4-10(5-7-11)14-12(16)15-8-2-1-3-9-15/h4-7H,1-3,8-9H2,(H,14,16).
What are the key properties of [4-(piperidine-1-carbonylamino)phenyl] hypofluorite?
[4-(piperidine-1-carbonylamino)phenyl] hypofluorite has a molecular weight of 238.26 g/mol, XLogP of 2.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(piperidine-1-carbonylamino)phenyl] hypofluorite is sourced from PubChem (CID 71166566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).