(4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole

C17H15N — CID 71485632

IUPAC(4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole
SMILESC(=C1/CCN=C1c1ccccc1)\c1ccccc1
InChIInChI=1S/C17H15N/c1-3-7-14(8-4-1)13-16-11-12-18-17(16)15-9-5-2-6-10-15/h1-10,13H,11-12H2/b16-13-
InChIKeyXNNXUKQRNXYRDF-SSZFMOIBSA-N
MW233.31 g/mol
LogP3.96
Rot. Bonds2

About (4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole

(4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole (PubChem CID 71485632) has the molecular formula C17H15N and a molecular weight of 233.31 g/mol. Its IUPAC name is (4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole.

Molecular Properties

Compound Name(4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole
PubChem CID71485632
Molecular FormulaC17H15N
Molecular Weight233.31 g/mol
Exact Mass233.12
IUPAC Name(4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole
SMILESC(=C1/CCN=C1c1ccccc1)\c1ccccc1
InChIInChI=1S/C17H15N/c1-3-7-14(8-4-1)13-16-11-12-18-17(16)15-9-5-2-6-10-15/h1-10,13H,11-12H2/b16-13-
InChIKeyXNNXUKQRNXYRDF-SSZFMOIBSA-N
XLogP3.96
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-[(5E)-5-[(4-phenylphenyl)methylidene]-3,4-dihydro-2H-pyridin-6-yl]pyridine;dihydrochloride
CID 161148903
3-[(5E)-5-[(4-methylphenyl)methylidene]-3,4-dihydro-2H-pyridin-6-yl]pyridine
CID 11550686
1-phenyl-3-[4-[(6-pyridin-3-yl-3,4-dihydro-2H-pyridin-5-ylidene)methyl]phenyl]urea
CID 67337458
4-benzhydrylidene-5-phenyl-2,3-dihydropyrrole
CID 71403996
3-[5-[(4-fluoro-3-phenylphenyl)methylidene]-3,4-dihydro-2H-pyridin-6-yl]pyridine
CID 67338026
(2Z,5E)-2,5-bis[(4-phenylphenyl)methylidene]cyclopentan-1-one
CID 2313575
[(E)-[(2E)-2-[(2E)-2-benzylidenecyclopentylidene]cyclopentylidene]methyl]benzene
CID 102353604
2-benzylidenecyclobutan-1-one
CID 73042587
[(E)-[(2E)-2-benzylidenecyclohexylidene]methyl]-trimethylsilane
CID 10539037
3,4,9,10-tetraphenyl-2,5,8,11-tetrazabicyclo[10.4.0]hexadeca-1(16),2,4,8,10,12,14-heptaene
CID 15873330
(6E)-2,6-dibenzylidenecyclohexan-1-one
CID 1240877
3-[(5E)-5-[[3-(2-methoxyphenyl)phenyl]methylidene]-3,4-dihydro-2H-pyridin-6-yl]pyridine
CID 24877523

Frequently Asked Questions

What is the IUPAC name of (4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole?
The IUPAC name of (4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole (CID 71485632) is (4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole.
What is the SMILES notation for (4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole?
The canonical SMILES for (4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole is C(=C1/CCN=C1c1ccccc1)\c1ccccc1.
What is the InChIKey of (4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole?
The InChIKey is XNNXUKQRNXYRDF-SSZFMOIBSA-N. The full InChI is InChI=1S/C17H15N/c1-3-7-14(8-4-1)13-16-11-12-18-17(16)15-9-5-2-6-10-15/h1-10,13H,11-12H2/b16-13-.
What are the key properties of (4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole?
(4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole has a molecular weight of 233.31 g/mol, XLogP of 3.96, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-4-benzylidene-5-phenyl-2,3-dihydropyrrole is sourced from PubChem (CID 71485632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).