2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine

C8H11N3 — CID 67041109

IUPAC2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine
SMILESC1=CN(c2ccc[nH]2)NCC1
InChIInChI=1S/C8H11N3/c1-2-7-11(10-6-1)8-4-3-5-9-8/h2-5,7,9-10H,1,6H2
InChIKeyFLNWYZVXENICKJ-UHFFFAOYSA-N
MW149.20 g/mol
LogP1.24
Rot. Bonds1

About 2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine

2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine (PubChem CID 67041109) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is 2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine.

Molecular Properties

Compound Name2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine
PubChem CID67041109
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC Name2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine
SMILESC1=CN(c2ccc[nH]2)NCC1
InChIInChI=1S/C8H11N3/c1-2-7-11(10-6-1)8-4-3-5-9-8/h2-5,7,9-10H,1,6H2
InChIKeyFLNWYZVXENICKJ-UHFFFAOYSA-N
XLogP1.24
TPSA31.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine?
The IUPAC name of 2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine (CID 67041109) is 2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine.
What is the SMILES notation for 2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine?
The canonical SMILES for 2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine is C1=CN(c2ccc[nH]2)NCC1.
What is the InChIKey of 2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine?
The InChIKey is FLNWYZVXENICKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3/c1-2-7-11(10-6-1)8-4-3-5-9-8/h2-5,7,9-10H,1,6H2.
What are the key properties of 2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine?
2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine has a molecular weight of 149.20 g/mol, XLogP of 1.24, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-pyrrol-2-yl)-5,6-dihydro-1H-pyridazine is sourced from PubChem (CID 67041109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).