(5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine

C14H15Cl2N3 — CID 6438784

IUPAC(5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine
SMILESCC1=NN=C(N(C)C)C/C1=C\c1c(Cl)cccc1Cl
InChIInChI=1S/C14H15Cl2N3/c1-9-10(8-14(18-17-9)19(2)3)7-11-12(15)5-4-6-13(11)16/h4-7H,8H2,1-3H3/b10-7+
InChIKeySDTCYIUGPGBUFB-JXMROGBWSA-N
MW296.20 g/mol
LogP4.12
Rot. Bonds1

About (5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine

(5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine (PubChem CID 6438784) has the molecular formula C14H15Cl2N3 and a molecular weight of 296.20 g/mol. Its IUPAC name is (5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine.

Molecular Properties

Compound Name(5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine
PubChem CID6438784
Molecular FormulaC14H15Cl2N3
Molecular Weight296.20 g/mol
Exact Mass295.06
IUPAC Name(5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine
SMILESCC1=NN=C(N(C)C)C/C1=C\c1c(Cl)cccc1Cl
InChIInChI=1S/C14H15Cl2N3/c1-9-10(8-14(18-17-9)19(2)3)7-11-12(15)5-4-6-13(11)16/h4-7H,8H2,1-3H3/b10-7+
InChIKeySDTCYIUGPGBUFB-JXMROGBWSA-N
XLogP4.12
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.20
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine?
The IUPAC name of (5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine (CID 6438784) is (5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine.
What is the SMILES notation for (5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine?
The canonical SMILES for (5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine is CC1=NN=C(N(C)C)C/C1=C\c1c(Cl)cccc1Cl.
What is the InChIKey of (5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine?
The InChIKey is SDTCYIUGPGBUFB-JXMROGBWSA-N. The full InChI is InChI=1S/C14H15Cl2N3/c1-9-10(8-14(18-17-9)19(2)3)7-11-12(15)5-4-6-13(11)16/h4-7H,8H2,1-3H3/b10-7+.
What are the key properties of (5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine?
(5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine has a molecular weight of 296.20 g/mol, XLogP of 4.12, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-[(2,6-dichlorophenyl)methylidene]-N,N,6-trimethyl-4H-pyridazin-3-amine is sourced from PubChem (CID 6438784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).