N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide

C25H23Cl2N3O — CID 56591526

IUPACN-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide
SMILESCCN(Cc1ccccc1)C(=O)Cc1c(-c2ccc(Cl)c(Cl)c2)nc2cc(C)ccn12
InChIInChI=1S/C25H23Cl2N3O/c1-3-29(16-18-7-5-4-6-8-18)24(31)15-22-25(19-9-10-20(26)21(27)14-19)28-23-13-17(2)11-12-30(22)23/h4-14H,3,15-16H2,1-2H3
InChIKeyOBCXJDCPGARBPX-UHFFFAOYSA-N
MW452.39 g/mol
LogP6.21
Rot. Bonds6

About N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide

N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide (PubChem CID 56591526) has the molecular formula C25H23Cl2N3O and a molecular weight of 452.39 g/mol. Its IUPAC name is N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide.

Molecular Properties

Compound NameN-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide
PubChem CID56591526
Molecular FormulaC25H23Cl2N3O
Molecular Weight452.39 g/mol
Exact Mass451.12
IUPAC NameN-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide
SMILESCCN(Cc1ccccc1)C(=O)Cc1c(-c2ccc(Cl)c(Cl)c2)nc2cc(C)ccn12
InChIInChI=1S/C25H23Cl2N3O/c1-3-29(16-18-7-5-4-6-8-18)24(31)15-22-25(19-9-10-20(26)21(27)14-19)28-23-13-17(2)11-12-30(22)23/h4-14H,3,15-16H2,1-2H3
InChIKeyOBCXJDCPGARBPX-UHFFFAOYSA-N
XLogP6.21
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500452.39
LogP ≤ 56.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide with MolForge

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Related Compounds

Alpidem
CID 54897
Zolpidem
CID 5732
Saripidem
CID 3058746
CB 34
CID 6603782
N-Butyl-2-[6,8-dichloro-2-(4-chloro-phenyl)-imidazo[1,2-a]pyridin-3-yl]-N-methyl-acetamide
CID 11201082
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CID 11328255
2-[2-(4-chlorophenyl)-6,8-dimethylimidazo[1,2-b]pyridazin-3-yl]-N,N-diethylacetamide
CID 44197009
2-[6,8-Dibromo-2-(4-chloro-phenyl)-imidazo[1,2-a]pyridin-3-yl]-N,N-dipropyl-acetamide
CID 10506326
7,8-Dichloro-4-[4-(2-methyl-imidazo[4,5-c]pyridin-1-yl)-phenyl]-1,3,4,5-tetrahydro-benzo[b]azepin-2-one
CID 10071745
1-{3-[6-Chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridine-3-yl]-1-oxopropyl}-4-(phenylmethyl)-4-piperidinol
CID 10142159
7,8-Dichloro-1-methyl-4-[4-(2-methyl-imidazo[4,5-c]pyridin-1-yl)-phenyl]-1,3,4,5-tetrahydro-benzo[b]azepin-2-one
CID 10478956
6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethyl-imidazo[1,2-a]pyridine-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide?
The IUPAC name of N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide (CID 56591526) is N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide.
What is the SMILES notation for N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide?
The canonical SMILES for N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide is CCN(Cc1ccccc1)C(=O)Cc1c(-c2ccc(Cl)c(Cl)c2)nc2cc(C)ccn12.
What is the InChIKey of N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide?
The InChIKey is OBCXJDCPGARBPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23Cl2N3O/c1-3-29(16-18-7-5-4-6-8-18)24(31)15-22-25(19-9-10-20(26)21(27)14-19)28-23-13-17(2)11-12-30(22)23/h4-14H,3,15-16H2,1-2H3.
What are the key properties of N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide?
N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide has a molecular weight of 452.39 g/mol, XLogP of 6.21, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[2-(3,4-dichlorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N-ethylacetamide is sourced from PubChem (CID 56591526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).