(Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine

C19H18N4 — CID 91558483

IUPAC(Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine
SMILESC/C=C\C(\C=N\C)=N\c1ccc2c(c1)ncn2-c1ccccc1
InChIInChI=1S/C19H18N4/c1-3-7-16(13-20-2)22-15-10-11-19-18(12-15)21-14-23(19)17-8-5-4-6-9-17/h3-14H,1-2H3/b7-3-,20-13+,22-16-
InChIKeyDTDQBZYOEWRINN-WDSPJTPLSA-N
MW302.38 g/mol
LogP4.37
Rot. Bonds4

About (Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine

(Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine (PubChem CID 91558483) has the molecular formula C19H18N4 and a molecular weight of 302.38 g/mol. Its IUPAC name is (Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine.

Molecular Properties

Compound Name(Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine
PubChem CID91558483
Molecular FormulaC19H18N4
Molecular Weight302.38 g/mol
Exact Mass302.15
IUPAC Name(Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine
SMILESC/C=C\C(\C=N\C)=N\c1ccc2c(c1)ncn2-c1ccccc1
InChIInChI=1S/C19H18N4/c1-3-7-16(13-20-2)22-15-10-11-19-18(12-15)21-14-23(19)17-8-5-4-6-9-17/h3-14H,1-2H3/b7-3-,20-13+,22-16-
InChIKeyDTDQBZYOEWRINN-WDSPJTPLSA-N
XLogP4.37
TPSA42.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine 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

5-phenyl-11-(1-phenylbenzimidazol-5-yl)indolo[3,2-b]carbazole
CID 118487922
5-azido-1-(3-methylphenyl)benzimidazole
CID 169325293
5-(2-methylphenyl)-1-phenylbenzimidazole
CID 144976138
ethyl 1-phenylbenzimidazole-5-carboxylate
CID 175878732
4-(benzimidazol-1-yl)benzaldehyde
CID 737733
1-[4-[(E)-2-[3-(benzimidazol-1-yl)phenyl]ethenyl]phenyl]-N-methylmethanimine
CID 130177862
(2E,4E)-N-[4-(benzimidazol-1-yl)phenyl]hexa-2,4-dienamide
CID 75413355
ethyl (E)-2-[[1-(4-chlorophenyl)benzimidazol-5-yl]iminomethyl]-3-hydroxybut-2-enoate
CID 135600088
5-tert-butyl-1-phenylbenzimidazole;9H-carbazole
CID 158745496
1-phenylbenzimidazole-5,6-dicarbonitrile
CID 16762723
1-phenyl-6-propan-2-ylbenzimidazol-5-amine
CID 155036311
6-methoxy-1-phenylbenzimidazole
CID 652633

Frequently Asked Questions

What is the IUPAC name of (Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine?
The IUPAC name of (Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine (CID 91558483) is (Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine.
What is the SMILES notation for (Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine?
The canonical SMILES for (Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine is C/C=C\C(\C=N\C)=N\c1ccc2c(c1)ncn2-c1ccccc1.
What is the InChIKey of (Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine?
The InChIKey is DTDQBZYOEWRINN-WDSPJTPLSA-N. The full InChI is InChI=1S/C19H18N4/c1-3-7-16(13-20-2)22-15-10-11-19-18(12-15)21-14-23(19)17-8-5-4-6-9-17/h3-14H,1-2H3/b7-3-,20-13+,22-16-.
What are the key properties of (Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine?
(Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine has a molecular weight of 302.38 g/mol, XLogP of 4.37, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-N-methyl-2-N-(1-phenylbenzimidazol-5-yl)pent-3-ene-1,2-diimine is sourced from PubChem (CID 91558483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).