(Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine

C13H10N4 — CID 5422737

IUPAC(Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine
SMILESC(=N\n1cnc2ccccc21)\c1cccnc1
InChIInChI=1S/C13H10N4/c1-2-6-13-12(5-1)15-10-17(13)16-9-11-4-3-7-14-8-11/h1-10H/b16-9-
InChIKeyFIDLZYUHCSHMPR-SXGWCWSVSA-N
MW222.25 g/mol
LogP2.31
Rot. Bonds2

About (Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine

(Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine (PubChem CID 5422737) has the molecular formula C13H10N4 and a molecular weight of 222.25 g/mol. Its IUPAC name is (Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine.

Molecular Properties

Compound Name(Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine
PubChem CID5422737
Molecular FormulaC13H10N4
Molecular Weight222.25 g/mol
Exact Mass222.09
IUPAC Name(Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine
SMILESC(=N\n1cnc2ccccc21)\c1cccnc1
InChIInChI=1S/C13H10N4/c1-2-6-13-12(5-1)15-10-17(13)16-9-11-4-3-7-14-8-11/h1-10H/b16-9-
InChIKeyFIDLZYUHCSHMPR-SXGWCWSVSA-N
XLogP2.31
TPSA43.07 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine
CID 9023831
N-(2-methylbenzimidazol-1-yl)-1-pyridin-3-ylmethanimine
CID 749135
(Z)-N-(benzimidazol-1-yl)-1-(4-propan-2-ylphenyl)methanimine
CID 9023604
(Z)-N-(benzimidazol-1-yl)-1-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)methanimine
CID 9023766
N-[4-[(Z)-benzimidazol-1-yliminomethyl]phenyl]acetamide
CID 9023565
1-pyridin-3-yl-N-(1,2,4-triazol-4-yl)methanimine
CID 660525
3-[(E)-pyridin-3-ylmethylideneamino]-5H-pyrimido[5,4-b]indol-4-one
CID 6881688
2-methyl-3-(pyridin-3-ylmethylideneamino)quinazolin-4-one
CID 882703
6-methyl-5-phenyl-3-[(E)-pyridin-3-ylmethylideneamino]thieno[2,3-d]pyrimidin-4-one
CID 6902460
[4-[(Z)-benzimidazol-1-yliminomethyl]-2,6-dimethoxyphenyl] acetate
CID 9023843
N-(3,5-diphenyl-1,2,4-triazol-4-yl)-1-pyridin-3-ylmethanimine
CID 786981
(E)-N-(benzimidazol-1-yl)-1-[5-(5-methylfuran-2-yl)-1H-pyrazol-4-yl]methanimine
CID 136915045

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine?
The IUPAC name of (Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine (CID 5422737) is (Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine.
What is the SMILES notation for (Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine?
The canonical SMILES for (Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine is C(=N\n1cnc2ccccc21)\c1cccnc1.
What is the InChIKey of (Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine?
The InChIKey is FIDLZYUHCSHMPR-SXGWCWSVSA-N. The full InChI is InChI=1S/C13H10N4/c1-2-6-13-12(5-1)15-10-17(13)16-9-11-4-3-7-14-8-11/h1-10H/b16-9-.
What are the key properties of (Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine?
(Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine has a molecular weight of 222.25 g/mol, XLogP of 2.31, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine is sourced from PubChem (CID 5422737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).