(E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine

C16H22N4 — CID 22947065

IUPAC(E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine
SMILESCc1cc/c(=N/N=c2\ccc(C)c(C)n2C)n(C)c1C
InChIInChI=1S/C16H22N4/c1-11-7-9-15(19(5)13(11)3)17-18-16-10-8-12(2)14(4)20(16)6/h7-10H,1-6H3/b17-15-,18-16+
InChIKeyPTZLXSDBISXWBI-JRDMOELTSA-N
MW270.38 g/mol
LogP2.01
Rot. Bonds1

About (E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine

(E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine (PubChem CID 22947065) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is (E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine.

Molecular Properties

Compound Name(E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine
PubChem CID22947065
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC Name(E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine
SMILESCc1cc/c(=N/N=c2\ccc(C)c(C)n2C)n(C)c1C
InChIInChI=1S/C16H22N4/c1-11-7-9-15(19(5)13(11)3)17-18-16-10-8-12(2)14(4)20(16)6/h7-10H,1-6H3/b17-15-,18-16+
InChIKeyPTZLXSDBISXWBI-JRDMOELTSA-N
XLogP2.01
TPSA34.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(E)-1,5,6-trimethyl-N-[(E)-(1,2,3-trimethyl-4-pyridinylidene)amino]pyridin-2-imine
CID 59873756
(Z)-1,5,6-trimethyl-N-[(Z)-(1,2,3-trimethyl-4-pyridinylidene)amino]pyridin-2-imine
CID 91491908

Frequently Asked Questions

What is the IUPAC name of (E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine?
The IUPAC name of (E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine (CID 22947065) is (E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine.
What is the SMILES notation for (E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine?
The canonical SMILES for (E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine is Cc1cc/c(=N/N=c2\ccc(C)c(C)n2C)n(C)c1C.
What is the InChIKey of (E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine?
The InChIKey is PTZLXSDBISXWBI-JRDMOELTSA-N. The full InChI is InChI=1S/C16H22N4/c1-11-7-9-15(19(5)13(11)3)17-18-16-10-8-12(2)14(4)20(16)6/h7-10H,1-6H3/b17-15-,18-16+.
What are the key properties of (E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine?
(E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine has a molecular weight of 270.38 g/mol, XLogP of 2.01, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,5,6-trimethyl-N-[(Z)-(1,5,6-trimethyl-2-pyridinylidene)amino]pyridin-2-imine is sourced from PubChem (CID 22947065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).