5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine

C14H17N3 — CID 123384783

IUPAC5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine
SMILESCC=c1nccc(C2=CN(C)N=CC2)/c1=C/C
InChIInChI=1S/C14H17N3/c1-4-12-13(7-8-15-14(12)5-2)11-6-9-16-17(3)10-11/h4-5,7-10H,6H2,1-3H3/b12-4-,14-5?
InChIKeyBGXDLVRJTRJDFB-IAAZDDHTSA-N
MW227.31 g/mol
LogP1.34
Rot. Bonds1

About 5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine

5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine (PubChem CID 123384783) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine.

Molecular Properties

Compound Name5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine
PubChem CID123384783
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine
SMILESCC=c1nccc(C2=CN(C)N=CC2)/c1=C/C
InChIInChI=1S/C14H17N3/c1-4-12-13(7-8-15-14(12)5-2)11-6-9-16-17(3)10-11/h4-5,7-10H,6H2,1-3H3/b12-4-,14-5?
InChIKeyBGXDLVRJTRJDFB-IAAZDDHTSA-N
XLogP1.34
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Ethane;5-methyl-6-methylidenepyrido[1,2-b]pyridazine
CID 91443773
3-Methyl-6-(3-methyl-3,4-dihydropyridin-6-yl)-4,5-dihydroazocine
CID 123985620
(E)-N-ethenyl-N-methyl-5-methylidene-1-methyliminonon-3-en-4-amine
CID 169626393
N-[(Z)-[(E)-2-[(2S)-1,2-dimethyl-3-propyl-2H-pyridin-4-yl]but-2-enylidene]amino]-N-methylethenamine
CID 169812937
3-(1-ethyl-4H-pyridazin-3-yl)-2H-azepine
CID 170977632

Frequently Asked Questions

What is the IUPAC name of 5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine?
The IUPAC name of 5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine (CID 123384783) is 5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine.
What is the SMILES notation for 5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine?
The canonical SMILES for 5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine is CC=c1nccc(C2=CN(C)N=CC2)/c1=C/C.
What is the InChIKey of 5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine?
The InChIKey is BGXDLVRJTRJDFB-IAAZDDHTSA-N. The full InChI is InChI=1S/C14H17N3/c1-4-12-13(7-8-15-14(12)5-2)11-6-9-16-17(3)10-11/h4-5,7-10H,6H2,1-3H3/b12-4-,14-5?.
What are the key properties of 5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine?
5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine has a molecular weight of 227.31 g/mol, XLogP of 1.34, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3Z)-2,3-di(ethylidene)-4-pyridinyl]-1-methyl-4H-pyridazine is sourced from PubChem (CID 123384783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).