2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole

C9H10N2 — CID 154514940

IUPAC2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole
SMILESCN1CC=CC1=C1C=CC=N1
InChIInChI=1S/C9H10N2/c1-11-7-3-5-9(11)8-4-2-6-10-8/h2-6H,7H2,1H3
InChIKeyCWOJBTAHUHSNOB-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.34
Rot. Bonds

About 2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole

2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole (PubChem CID 154514940) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole.

Molecular Properties

Compound Name2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole
PubChem CID154514940
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole
SMILESCN1CC=CC1=C1C=CC=N1
InChIInChI=1S/C9H10N2/c1-11-7-3-5-9(11)8-4-2-6-10-8/h2-6H,7H2,1H3
InChIKeyCWOJBTAHUHSNOB-UHFFFAOYSA-N
XLogP1.34
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole?
The IUPAC name of 2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole (CID 154514940) is 2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole.
What is the SMILES notation for 2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole?
The canonical SMILES for 2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole is CN1CC=CC1=C1C=CC=N1.
What is the InChIKey of 2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole?
The InChIKey is CWOJBTAHUHSNOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c1-11-7-3-5-9(11)8-4-2-6-10-8/h2-6H,7H2,1H3.
What are the key properties of 2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole?
2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole has a molecular weight of 146.19 g/mol, XLogP of 1.34, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-2H-pyrrol-5-ylidene)pyrrole is sourced from PubChem (CID 154514940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).