(3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine

C11H12FN — CID 122235633

IUPAC(3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine
SMILESFc1ccc(/C=C2/CCNC2)cc1
InChIInChI=1S/C11H12FN/c12-11-3-1-9(2-4-11)7-10-5-6-13-8-10/h1-4,7,13H,5-6,8H2/b10-7-
InChIKeyQYHDJNMXBPWUMI-YFHOEESVSA-N
MW177.22 g/mol
LogP2.20
Rot. Bonds1

About (3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine

(3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine (PubChem CID 122235633) has the molecular formula C11H12FN and a molecular weight of 177.22 g/mol. Its IUPAC name is (3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine.

Molecular Properties

Compound Name(3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine
PubChem CID122235633
Molecular FormulaC11H12FN
Molecular Weight177.22 g/mol
Exact Mass177.10
IUPAC Name(3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine
SMILESFc1ccc(/C=C2/CCNC2)cc1
InChIInChI=1S/C11H12FN/c12-11-3-1-9(2-4-11)7-10-5-6-13-8-10/h1-4,7,13H,5-6,8H2/b10-7-
InChIKeyQYHDJNMXBPWUMI-YFHOEESVSA-N
XLogP2.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.22
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3E)-3-[(4-fluorophenyl)methylidene]pyrrolidine
CID 66524773
(4E)-4-[(4-fluorophenyl)methylidene]azepane
CID 134385751
3-[(2,5-difluorophenyl)methylidene]pyrrolidine
CID 79879908
4-[(4-fluorophenyl)methylidene]oxane
CID 20583144
3-[[3-(trifluoromethyl)phenyl]methylidene]pyrrolidine
CID 79880639
3-[(3-bromophenyl)methylidene]pyrrolidine
CID 79880535
3-[(3,5-difluorophenyl)methylidene]azetidine
CID 105411336
3-[(4-chlorophenyl)methylidene]azetidine
CID 79879268
4-[(4-methoxyphenyl)methylidene]piperidine
CID 20811455
4-[(4-bromophenyl)methylidene]azepane
CID 71276688
3-[(4-fluorophenyl)methylidene]-8-azabicyclo[3.2.1]octane;hydrochloride
CID 126844806
3-[(4-fluorophenyl)methylidene]piperidin-2-one
CID 57351446

Frequently Asked Questions

What is the IUPAC name of (3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine?
The IUPAC name of (3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine (CID 122235633) is (3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine.
What is the SMILES notation for (3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine?
The canonical SMILES for (3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine is Fc1ccc(/C=C2/CCNC2)cc1.
What is the InChIKey of (3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine?
The InChIKey is QYHDJNMXBPWUMI-YFHOEESVSA-N. The full InChI is InChI=1S/C11H12FN/c12-11-3-1-9(2-4-11)7-10-5-6-13-8-10/h1-4,7,13H,5-6,8H2/b10-7-.
What are the key properties of (3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine?
(3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine has a molecular weight of 177.22 g/mol, XLogP of 2.20, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-[(4-fluorophenyl)methylidene]pyrrolidine is sourced from PubChem (CID 122235633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).