(5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one

C11H7Br2NO — CID 155512558

IUPAC(5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one
SMILESO=C1C=C(c2ccc(Br)cc2)/C(=C/Br)N1
InChIInChI=1S/C11H7Br2NO/c12-6-10-9(5-11(15)14-10)7-1-3-8(13)4-2-7/h1-6H,(H,14,15)/b10-6-
InChIKeyYGEFUMYLGDAPSK-POHAHGRESA-N
MW328.99 g/mol
LogP3.20
Rot. Bonds1

About (5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one

(5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one (PubChem CID 155512558) has the molecular formula C11H7Br2NO and a molecular weight of 328.99 g/mol. Its IUPAC name is (5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one.

Molecular Properties

Compound Name(5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one
PubChem CID155512558
Molecular FormulaC11H7Br2NO
Molecular Weight328.99 g/mol
Exact Mass326.89
IUPAC Name(5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one
SMILESO=C1C=C(c2ccc(Br)cc2)/C(=C/Br)N1
InChIInChI=1S/C11H7Br2NO/c12-6-10-9(5-11(15)14-10)7-1-3-8(13)4-2-7/h1-6H,(H,14,15)/b10-6-
InChIKeyYGEFUMYLGDAPSK-POHAHGRESA-N
XLogP3.20
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.99
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one?
The IUPAC name of (5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one (CID 155512558) is (5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one.
What is the SMILES notation for (5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one?
The canonical SMILES for (5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one is O=C1C=C(c2ccc(Br)cc2)/C(=C/Br)N1.
What is the InChIKey of (5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one?
The InChIKey is YGEFUMYLGDAPSK-POHAHGRESA-N. The full InChI is InChI=1S/C11H7Br2NO/c12-6-10-9(5-11(15)14-10)7-1-3-8(13)4-2-7/h1-6H,(H,14,15)/b10-6-.
What are the key properties of (5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one?
(5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one has a molecular weight of 328.99 g/mol, XLogP of 3.20, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-(bromomethylidene)-4-(4-bromophenyl)pyrrol-2-one is sourced from PubChem (CID 155512558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).