(2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen

C12H11F2N — CID 172606692

IUPAC(2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen
SMILESC=c1cc(-c2ccc(F)cc2)[nH]/c1=C\F.[H][H]
InChIInChI=1S/C12H9F2N.H2/c1-8-6-11(15-12(8)7-13)9-2-4-10(14)5-3-9;/h2-7,15H,1H2;1H/b12-7-;
InChIKeyDVPJANLALAPEDE-OZLKFZLXSA-N
MW207.22 g/mol
LogP2.18
Rot. Bonds1

About (2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen

(2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen (PubChem CID 172606692) has the molecular formula C12H11F2N and a molecular weight of 207.22 g/mol. Its IUPAC name is (2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen.

Molecular Properties

Compound Name(2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen
PubChem CID172606692
Molecular FormulaC12H11F2N
Molecular Weight207.22 g/mol
Exact Mass207.09
IUPAC Name(2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen
SMILESC=c1cc(-c2ccc(F)cc2)[nH]/c1=C\F.[H][H]
InChIInChI=1S/C12H9F2N.H2/c1-8-6-11(15-12(8)7-13)9-2-4-10(14)5-3-9;/h2-7,15H,1H2;1H/b12-7-;
InChIKeyDVPJANLALAPEDE-OZLKFZLXSA-N
XLogP2.18
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.22
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

2-ethenyl-5-(4-fluorophenyl)-1H-pyrrole
CID 167028653
5-(4-fluorophenyl)-1H-pyrrol-2-amine
CID 117223095
1-fluoro-4-[4-[4-[4-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 58320925
1-fluoro-4-(4-fluorophenyl)benzene;formaldehyde
CID 175463820
1-fluoro-4-[2-(4-fluorophenyl)-3-methylidenecyclopenta-1,4-dien-1-yl]benzene
CID 139880103
5-(4-fluorophenyl)-2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-1H-pyrrole
CID 144654626
6-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carbaldehyde
CID 82519690
3-[2,5-bis(4-fluorophenyl)-1H-pyrrol-3-yl]propanal
CID 169229930
3-ethyl-6-(4-fluorophenyl)-1H-pyrimidine-2,4-dione
CID 122239134
7-fluoro-2-(4-fluorophenyl)-1H-indol-4-amine
CID 82385922
1,2,3-trifluoro-5-(4-fluorophenyl)benzene
CID 12982677
[3-(4-fluorophenyl)-4-methylphenyl]-methyl-methylideneazanium
CID 138652346

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen?
The IUPAC name of (2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen (CID 172606692) is (2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen.
What is the SMILES notation for (2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen?
The canonical SMILES for (2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen is C=c1cc(-c2ccc(F)cc2)[nH]/c1=C\F.[H][H].
What is the InChIKey of (2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen?
The InChIKey is DVPJANLALAPEDE-OZLKFZLXSA-N. The full InChI is InChI=1S/C12H9F2N.H2/c1-8-6-11(15-12(8)7-13)9-2-4-10(14)5-3-9;/h2-7,15H,1H2;1H/b12-7-;.
What are the key properties of (2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen?
(2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen has a molecular weight of 207.22 g/mol, XLogP of 2.18, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(fluoromethylidene)-5-(4-fluorophenyl)-3-methylidene-1H-pyrrole;molecular hydrogen is sourced from PubChem (CID 172606692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).