(Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine

C18H13N3 — CID 9023831

IUPAC(Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine
SMILESC(=N\n1cnc2ccccc21)\c1ccc2ccccc2c1
InChIInChI=1S/C18H13N3/c1-2-6-16-11-14(9-10-15(16)5-1)12-20-21-13-19-17-7-3-4-8-18(17)21/h1-13H/b20-12-
InChIKeyZTVZAAVTYXZKBY-NDENLUEZSA-N
MW271.32 g/mol
LogP4.07
Rot. Bonds2

About (Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine

(Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine (PubChem CID 9023831) has the molecular formula C18H13N3 and a molecular weight of 271.32 g/mol. Its IUPAC name is (Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine.

Molecular Properties

Compound Name(Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine
PubChem CID9023831
Molecular FormulaC18H13N3
Molecular Weight271.32 g/mol
Exact Mass271.11
IUPAC Name(Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine
SMILESC(=N\n1cnc2ccccc21)\c1ccc2ccccc2c1
InChIInChI=1S/C18H13N3/c1-2-6-16-11-14(9-10-15(16)5-1)12-20-21-13-19-17-7-3-4-8-18(17)21/h1-13H/b20-12-
InChIKeyZTVZAAVTYXZKBY-NDENLUEZSA-N
XLogP4.07
TPSA30.18 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(Z)-N-(benzimidazol-1-yl)-1-(4-propan-2-ylphenyl)methanimine
CID 9023604
(Z)-N-(benzimidazol-1-yl)-1-pyridin-3-ylmethanimine
CID 5422737
N-[4-[(Z)-benzimidazol-1-yliminomethyl]phenyl]acetamide
CID 9023565
[4-[(Z)-benzimidazol-1-yliminomethyl]-2-methoxyphenyl] 4-methoxybenzoate
CID 9023683
[4-[(Z)-benzimidazol-1-yliminomethyl]-2,6-dimethoxyphenyl] acetate
CID 9023843
[4-[(Z)-benzimidazol-1-yliminomethyl]-2-methoxyphenyl] 4-fluorobenzoate
CID 9023689
methyl 4-[[4-[(Z)-benzimidazol-1-yliminomethyl]-2-methoxyphenoxy]methyl]benzoate
CID 9023669
3-[(E)-naphthalen-2-ylmethylideneamino]-5-phenylthieno[2,3-d]pyrimidin-4-one
CID 42993564
6-ethyl-3-[(Z)-naphthalen-2-ylmethylideneamino]thieno[2,3-d]pyrimidin-4-one
CID 9174718
3-[(Z)-2-naphthalen-2-ylethenyl]quinoline
CID 11300516
2-[4-[(Z)-benzimidazol-1-yliminomethyl]-2-ethoxyphenoxy]-1-piperidin-1-ylethanone
CID 9023964
3-[3-[(Z)-benzimidazol-1-yliminomethyl]indol-1-yl]propanenitrile
CID 9023975

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine?
The IUPAC name of (Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine (CID 9023831) is (Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine.
What is the SMILES notation for (Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine?
The canonical SMILES for (Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine is C(=N\n1cnc2ccccc21)\c1ccc2ccccc2c1.
What is the InChIKey of (Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine?
The InChIKey is ZTVZAAVTYXZKBY-NDENLUEZSA-N. The full InChI is InChI=1S/C18H13N3/c1-2-6-16-11-14(9-10-15(16)5-1)12-20-21-13-19-17-7-3-4-8-18(17)21/h1-13H/b20-12-.
What are the key properties of (Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine?
(Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine has a molecular weight of 271.32 g/mol, XLogP of 4.07, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(benzimidazol-1-yl)-1-naphthalen-2-ylmethanimine is sourced from PubChem (CID 9023831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).