2-methylidene-5-phenyl-1,3-dihydropyrrole

C11H11N — CID 72537888

IUPAC2-methylidene-5-phenyl-1,3-dihydropyrrole
SMILESC=C1CC=C(c2ccccc2)N1
InChIInChI=1S/C11H11N/c1-9-7-8-11(12-9)10-5-3-2-4-6-10/h2-6,8,12H,1,7H2
InChIKeyOMIZVLAADCFDGS-UHFFFAOYSA-N
MW157.22 g/mol
LogP2.53
Rot. Bonds1

About 2-methylidene-5-phenyl-1,3-dihydropyrrole

2-methylidene-5-phenyl-1,3-dihydropyrrole (PubChem CID 72537888) has the molecular formula C11H11N and a molecular weight of 157.22 g/mol. Its IUPAC name is 2-methylidene-5-phenyl-1,3-dihydropyrrole.

Molecular Properties

Compound Name2-methylidene-5-phenyl-1,3-dihydropyrrole
PubChem CID72537888
Molecular FormulaC11H11N
Molecular Weight157.22 g/mol
Exact Mass157.09
IUPAC Name2-methylidene-5-phenyl-1,3-dihydropyrrole
SMILESC=C1CC=C(c2ccccc2)N1
InChIInChI=1S/C11H11N/c1-9-7-8-11(12-9)10-5-3-2-4-6-10/h2-6,8,12H,1,7H2
InChIKeyOMIZVLAADCFDGS-UHFFFAOYSA-N
XLogP2.53
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-methylidene-2-phenyl-1H-quinoline
CID 89408092
benzene;tris(1,1'-biphenyl)
CID 162155747
2-methylidene-5-phenyl-3H-pyridine
CID 167214063
6-phenyl-2-propan-2-yl-1,4-dihydropyrimidine
CID 58588586
3-phenyl-2,5-dihydro-1H-pyridin-6-one
CID 142702456
1,1'-biphenyl;cycloheptane
CID 174877368
2-phenyl-1,4-dihydroquinoxaline
CID 67760768
5-phenyl-1H-pyrrole-2,3-dione
CID 13165116
2-methylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepine
CID 59966586
N-(6-phenyl-1,4-dihydropyridazin-3-yl)-2-sulfanylacetamide
CID 143960317
1,1'-biphenyl;indigane
CID 174363765
1,1'-biphenyl;hydroiodide
CID 66586334

Frequently Asked Questions

What is the IUPAC name of 2-methylidene-5-phenyl-1,3-dihydropyrrole?
The IUPAC name of 2-methylidene-5-phenyl-1,3-dihydropyrrole (CID 72537888) is 2-methylidene-5-phenyl-1,3-dihydropyrrole.
What is the SMILES notation for 2-methylidene-5-phenyl-1,3-dihydropyrrole?
The canonical SMILES for 2-methylidene-5-phenyl-1,3-dihydropyrrole is C=C1CC=C(c2ccccc2)N1.
What is the InChIKey of 2-methylidene-5-phenyl-1,3-dihydropyrrole?
The InChIKey is OMIZVLAADCFDGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N/c1-9-7-8-11(12-9)10-5-3-2-4-6-10/h2-6,8,12H,1,7H2.
What are the key properties of 2-methylidene-5-phenyl-1,3-dihydropyrrole?
2-methylidene-5-phenyl-1,3-dihydropyrrole has a molecular weight of 157.22 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-5-phenyl-1,3-dihydropyrrole is sourced from PubChem (CID 72537888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).