[6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone

C22H29N3O — CID 42878718

IUPAC[6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone
SMILESCCc1ccc(C2CCc3nc(C(=O)N4CCC(C)CC4)cn3C2)cc1
InChIInChI=1S/C22H29N3O/c1-3-17-4-6-18(7-5-17)19-8-9-21-23-20(15-25(21)14-19)22(26)24-12-10-16(2)11-13-24/h4-7,15-16,19H,3,8-14H2,1-2H3
InChIKeyDFXCFGDNWNOGBX-UHFFFAOYSA-N
MW351.49 g/mol
LogP4.05
Rot. Bonds3

About [6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone

[6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone (PubChem CID 42878718) has the molecular formula C22H29N3O and a molecular weight of 351.49 g/mol. Its IUPAC name is [6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone
PubChem CID42878718
Molecular FormulaC22H29N3O
Molecular Weight351.49 g/mol
Exact Mass351.23
IUPAC Name[6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone
SMILESCCc1ccc(C2CCc3nc(C(=O)N4CCC(C)CC4)cn3C2)cc1
InChIInChI=1S/C22H29N3O/c1-3-17-4-6-18(7-5-17)19-8-9-21-23-20(15-25(21)14-19)22(26)24-12-10-16(2)11-13-24/h4-7,15-16,19H,3,8-14H2,1-2H3
InChIKeyDFXCFGDNWNOGBX-UHFFFAOYSA-N
XLogP4.05
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.49
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone
CID 42878709
ethyl 4-(6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carbonyl)piperazine-1-carboxylate
CID 46080879
(6R)-6-(4-ethylphenyl)-N-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
CID 93013489
[(6S)-6-(4-phenoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-pyrrolidin-1-ylmethanone
CID 93013241
ethyl 6-(4-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxylate
CID 138646151
(4-ethylpiperazin-1-yl)-[6-(2-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone
CID 46080938
ethyl 4-[(6R)-6-[3-(trifluoromethyl)phenyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carbonyl]piperazine-1-carboxylate
CID 93013112
[3-(4-ethylphenyl)pyrrolidin-1-yl]-[2-(methoxymethyl)-1,3-thiazol-4-yl]methanone
CID 136544722
6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-2-yl-(4-methylpiperidin-1-yl)methanone
CID 71838110
1,4-dioxa-8-azaspiro[4.5]decan-8-yl-[6-(3-methylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone
CID 46080951
(6R)-N-[(4-fluorophenyl)methyl]-6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-2-carboxamide
CID 93009766
(4-benzhydrylpiperazin-1-yl)-[6-(4-methoxy-3,5-dimethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone
CID 46081124

Frequently Asked Questions

What is the IUPAC name of [6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of [6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone (CID 42878718) is [6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for [6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for [6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone is CCc1ccc(C2CCc3nc(C(=O)N4CCC(C)CC4)cn3C2)cc1.
What is the InChIKey of [6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone?
The InChIKey is DFXCFGDNWNOGBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O/c1-3-17-4-6-18(7-5-17)19-8-9-21-23-20(15-25(21)14-19)22(26)24-12-10-16(2)11-13-24/h4-7,15-16,19H,3,8-14H2,1-2H3.
What are the key properties of [6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone?
[6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone has a molecular weight of 351.49 g/mol, XLogP of 4.05, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(4-ethylphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 42878718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).