(2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole

C15H11BrN2 — CID 73356806

IUPAC(2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole
SMILESBrc1ccccc1/C(=C1\C=CC=N1)c1ccc[nH]1
InChIInChI=1S/C15H11BrN2/c16-12-6-2-1-5-11(12)15(13-7-3-9-17-13)14-8-4-10-18-14/h1-10,17H/b15-14-
InChIKeyMKZTYWDWTTXCSK-PFONDFGASA-N
MW299.17 g/mol
LogP4.18
Rot. Bonds2

About (2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole

(2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole (PubChem CID 73356806) has the molecular formula C15H11BrN2 and a molecular weight of 299.17 g/mol. Its IUPAC name is (2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole.

Molecular Properties

Compound Name(2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole
PubChem CID73356806
Molecular FormulaC15H11BrN2
Molecular Weight299.17 g/mol
Exact Mass298.01
IUPAC Name(2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole
SMILESBrc1ccccc1/C(=C1\C=CC=N1)c1ccc[nH]1
InChIInChI=1S/C15H11BrN2/c16-12-6-2-1-5-11(12)15(13-7-3-9-17-13)14-8-4-10-18-14/h1-10,17H/b15-14-
InChIKeyMKZTYWDWTTXCSK-PFONDFGASA-N
XLogP4.18
TPSA28.15 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.17
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-Bromoindole
CID 24905
5-Bromotryptamine
CID 77158
Nomelidine
CID 5378630
2-Phenylpyrrole
CID 72898
Norzimelidine
CID 6437872
Indole, 5-bromo-3-(dimethylamino)methyl-
CID 13249
4,5,6,7-Tetrahydroindole
CID 97429
6-Bromoindole
CID 676493
Nornicotyrine
CID 68125
1H-Pyrrole-2-methanamine, N-(phenylmethyl)-
CID 413448
N-methyl,N-(benzyl),N-(pyrrol-2-ylmethyl)amine
CID 11805737
2-(6-Bromo-pyridin-3-yl)-7-aza-bicyclo[2.2.1]heptane
CID 22468064

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole?
The IUPAC name of (2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole (CID 73356806) is (2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole.
What is the SMILES notation for (2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole?
The canonical SMILES for (2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole is Brc1ccccc1/C(=C1\C=CC=N1)c1ccc[nH]1.
What is the InChIKey of (2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole?
The InChIKey is MKZTYWDWTTXCSK-PFONDFGASA-N. The full InChI is InChI=1S/C15H11BrN2/c16-12-6-2-1-5-11(12)15(13-7-3-9-17-13)14-8-4-10-18-14/h1-10,17H/b15-14-.
What are the key properties of (2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole?
(2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole has a molecular weight of 299.17 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-[(2-bromophenyl)-(1H-pyrrol-2-yl)methylidene]pyrrole is sourced from PubChem (CID 73356806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).