1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine

C21H16ClN3 — CID 917162

IUPAC1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine
SMILESCc1ccn2cc(-c3cccc(/N=C/c4ccc(Cl)cc4)c3)nc2c1
InChIInChI=1S/C21H16ClN3/c1-15-9-10-25-14-20(24-21(25)11-15)17-3-2-4-19(12-17)23-13-16-5-7-18(22)8-6-16/h2-14H,1H3/b23-13+
InChIKeyHWFMVFSRZDYHMA-YDZHTSKRSA-N
MW345.83 g/mol
LogP5.71
Rot. Bonds3

About 1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine

1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine (PubChem CID 917162) has the molecular formula C21H16ClN3 and a molecular weight of 345.83 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine
PubChem CID917162
Molecular FormulaC21H16ClN3
Molecular Weight345.83 g/mol
Exact Mass345.10
IUPAC Name1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine
SMILESCc1ccn2cc(-c3cccc(/N=C/c4ccc(Cl)cc4)c3)nc2c1
InChIInChI=1S/C21H16ClN3/c1-15-9-10-25-14-20(24-21(25)11-15)17-3-2-4-19(12-17)23-13-16-5-7-18(22)8-6-16/h2-14H,1H3/b23-13+
InChIKeyHWFMVFSRZDYHMA-YDZHTSKRSA-N
XLogP5.71
TPSA29.66 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.83
LogP ≤ 55.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine?
The IUPAC name of 1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine (CID 917162) is 1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine.
What is the SMILES notation for 1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine?
The canonical SMILES for 1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine is Cc1ccn2cc(-c3cccc(/N=C/c4ccc(Cl)cc4)c3)nc2c1.
What is the InChIKey of 1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine?
The InChIKey is HWFMVFSRZDYHMA-YDZHTSKRSA-N. The full InChI is InChI=1S/C21H16ClN3/c1-15-9-10-25-14-20(24-21(25)11-15)17-3-2-4-19(12-17)23-13-16-5-7-18(22)8-6-16/h2-14H,1H3/b23-13+.
What are the key properties of 1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine?
1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine has a molecular weight of 345.83 g/mol, XLogP of 5.71, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-[3-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanimine is sourced from PubChem (CID 917162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).