2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine

C22H27ClN2O — CID 23582662

IUPAC2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine
SMILESCCc1c(-c2ccc(OC)cc2Cl)nc2c(C)cc(C(CC)CC)cn12
InChIInChI=1S/C22H27ClN2O/c1-6-15(7-2)16-11-14(4)22-24-21(20(8-3)25(22)13-16)18-10-9-17(26-5)12-19(18)23/h9-13,15H,6-8H2,1-5H3
InChIKeyBYQSAFVIQKLITC-UHFFFAOYSA-N
MW370.92 g/mol
LogP6.44
Rot. Bonds6

About 2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine

2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine (PubChem CID 23582662) has the molecular formula C22H27ClN2O and a molecular weight of 370.92 g/mol. Its IUPAC name is 2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine
PubChem CID23582662
Molecular FormulaC22H27ClN2O
Molecular Weight370.92 g/mol
Exact Mass370.18
IUPAC Name2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine
SMILESCCc1c(-c2ccc(OC)cc2Cl)nc2c(C)cc(C(CC)CC)cn12
InChIInChI=1S/C22H27ClN2O/c1-6-15(7-2)16-11-14(4)22-24-21(20(8-3)25(22)13-16)18-10-9-17(26-5)12-19(18)23/h9-13,15H,6-8H2,1-5H3
InChIKeyBYQSAFVIQKLITC-UHFFFAOYSA-N
XLogP6.44
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.92
LogP ≤ 56.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-chloro-4-methoxyphenyl)-8-methyl-3-methylsulfonyl-6-pentan-3-ylimidazo[1,2-a]pyridine
CID 69062093
2-(2-chloro-4-methoxyphenyl)-3,8-dimethyl-N,N-dipropylimidazo[1,2-a]pyridin-6-amine
CID 69060670
2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide
CID 69061516
5-(2-chloro-4-methoxyphenyl)-6-methyl-1-pentan-3-yl-2,3-dihydroimidazo[4,5-b]pyrazine
CID 143146095
2-(2-chloro-4-methoxyphenyl)-3-methylpyridine
CID 42624977
5-(2-chloro-4-methoxyphenyl)-2-ethylimidazo[1,2-a]pyridine
CID 142507774
7-(2-chloro-4-methoxyphenyl)-4-(1-cyclopropylpropyl)-2-ethyl-1H-imidazo[4,5-d]pyridazine
CID 18516048
2-(2-chloro-4-methoxyphenyl)-3-(2-hydroxyethyl)-7-methyl-5-pentan-3-ylpyrrolo[2,1-f][1,2,4]triazin-4-one
CID 57398970
6-(2-chloro-4-methoxyphenyl)-N,3-dimethyl-1,2,4-triazin-5-amine
CID 116823608
2-chloro-4-methoxy-1-methylbenzene
CID 6951757
5-bromo-6-(2-chloro-4-methoxyphenyl)-3-hexan-3-yloxy-N-methylpyrazin-2-amine
CID 58804456
5-methoxy-15-methyl-11,17-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2(7),3,5,12,14,16-heptaen-13-amine
CID 115910833

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine?
The IUPAC name of 2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine (CID 23582662) is 2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine?
The canonical SMILES for 2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine is CCc1c(-c2ccc(OC)cc2Cl)nc2c(C)cc(C(CC)CC)cn12.
What is the InChIKey of 2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine?
The InChIKey is BYQSAFVIQKLITC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27ClN2O/c1-6-15(7-2)16-11-14(4)22-24-21(20(8-3)25(22)13-16)18-10-9-17(26-5)12-19(18)23/h9-13,15H,6-8H2,1-5H3.
What are the key properties of 2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine?
2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine has a molecular weight of 370.92 g/mol, XLogP of 6.44, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-methoxyphenyl)-3-ethyl-8-methyl-6-pentan-3-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 23582662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).