2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide

C24H22Cl2N4O — CID 56591615

IUPAC2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide
SMILESCCN(Cc1ccccn1)C(=O)Cc1c(-c2ccc(Cl)c(Cl)c2)nc2cc(C)ccn12
InChIInChI=1S/C24H22Cl2N4O/c1-3-29(15-18-6-4-5-10-27-18)23(31)14-21-24(17-7-8-19(25)20(26)13-17)28-22-12-16(2)9-11-30(21)22/h4-13H,3,14-15H2,1-2H3
InChIKeyILPWQHIEKZASOY-UHFFFAOYSA-N
MW453.37 g/mol
LogP5.60
Rot. Bonds6

About 2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide

2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 56591615) has the molecular formula C24H22Cl2N4O and a molecular weight of 453.37 g/mol. Its IUPAC name is 2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide
PubChem CID56591615
Molecular FormulaC24H22Cl2N4O
Molecular Weight453.37 g/mol
Exact Mass452.12
IUPAC Name2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide
SMILESCCN(Cc1ccccn1)C(=O)Cc1c(-c2ccc(Cl)c(Cl)c2)nc2cc(C)ccn12
InChIInChI=1S/C24H22Cl2N4O/c1-3-29(15-18-6-4-5-10-27-18)23(31)14-21-24(17-7-8-19(25)20(26)13-17)28-22-12-16(2)9-11-30(21)22/h4-13H,3,14-15H2,1-2H3
InChIKeyILPWQHIEKZASOY-UHFFFAOYSA-N
XLogP5.60
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500453.37
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide (CID 56591615) is 2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide is CCN(Cc1ccccn1)C(=O)Cc1c(-c2ccc(Cl)c(Cl)c2)nc2cc(C)ccn12.
What is the InChIKey of 2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is ILPWQHIEKZASOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22Cl2N4O/c1-3-29(15-18-6-4-5-10-27-18)23(31)14-21-24(17-7-8-19(25)20(26)13-17)28-22-12-16(2)9-11-30(21)22/h4-13H,3,14-15H2,1-2H3.
What are the key properties of 2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide?
2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 453.37 g/mol, XLogP of 5.60, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethyl-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 56591615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).