(2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole

C11H14FN — CID 145145210

IUPAC(2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole
SMILESC=C/C(F)=c1/[nH]c(C)cc1=C(C)C
InChIInChI=1S/C11H14FN/c1-5-10(12)11-9(7(2)3)6-8(4)13-11/h5-6,13H,1H2,2-4H3/b11-10-
InChIKeyRZKPFKYGFHRPAQ-KHPPLWFESA-N
MW179.24 g/mol
LogP1.78
Rot. Bonds1

About (2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole

(2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole (PubChem CID 145145210) has the molecular formula C11H14FN and a molecular weight of 179.24 g/mol. Its IUPAC name is (2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole.

Molecular Properties

Compound Name(2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole
PubChem CID145145210
Molecular FormulaC11H14FN
Molecular Weight179.24 g/mol
Exact Mass179.11
IUPAC Name(2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole
SMILESC=C/C(F)=c1/[nH]c(C)cc1=C(C)C
InChIInChI=1S/C11H14FN/c1-5-10(12)11-9(7(2)3)6-8(4)13-11/h5-6,13H,1H2,2-4H3/b11-10-
InChIKeyRZKPFKYGFHRPAQ-KHPPLWFESA-N
XLogP1.78
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.24
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Analyze (2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole?
The IUPAC name of (2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole (CID 145145210) is (2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole.
What is the SMILES notation for (2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole?
The canonical SMILES for (2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole is C=C/C(F)=c1/[nH]c(C)cc1=C(C)C.
What is the InChIKey of (2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole?
The InChIKey is RZKPFKYGFHRPAQ-KHPPLWFESA-N. The full InChI is InChI=1S/C11H14FN/c1-5-10(12)11-9(7(2)3)6-8(4)13-11/h5-6,13H,1H2,2-4H3/b11-10-.
What are the key properties of (2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole?
(2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole has a molecular weight of 179.24 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(1-fluoroprop-2-enylidene)-5-methyl-3-propan-2-ylidene-1H-pyrrole is sourced from PubChem (CID 145145210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).