[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone

C19H27N5O2 — CID 119837434

IUPAC[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone
SMILESCOC1(C(=O)N2CCN(Cc3cn4ccccc4n3)CC2)CCNCC1
InChIInChI=1S/C19H27N5O2/c1-26-19(5-7-20-8-6-19)18(25)23-12-10-22(11-13-23)14-16-15-24-9-3-2-4-17(24)21-16/h2-4,9,15,20H,5-8,10-14H2,1H3
InChIKeyZGBHHQDEWRRFKC-UHFFFAOYSA-N
MW357.46 g/mol
LogP0.75
Rot. Bonds4

About [4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone

[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone (PubChem CID 119837434) has the molecular formula C19H27N5O2 and a molecular weight of 357.46 g/mol. Its IUPAC name is [4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone.

Molecular Properties

Compound Name[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone
PubChem CID119837434
Molecular FormulaC19H27N5O2
Molecular Weight357.46 g/mol
Exact Mass357.22
IUPAC Name[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone
SMILESCOC1(C(=O)N2CCN(Cc3cn4ccccc4n3)CC2)CCNCC1
InChIInChI=1S/C19H27N5O2/c1-26-19(5-7-20-8-6-19)18(25)23-12-10-22(11-13-23)14-16-15-24-9-3-2-4-17(24)21-16/h2-4,9,15,20H,5-8,10-14H2,1H3
InChIKeyZGBHHQDEWRRFKC-UHFFFAOYSA-N
XLogP0.75
TPSA62.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone with MolForge

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Related Compounds

(1-aminocyclopropyl)-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]methanone;dihydrochloride
CID 119837365
[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone
CID 119876180
1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-3-piperidin-4-ylbutan-1-one;dihydrochloride
CID 119837429
2-(4-fluorophenyl)-1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]ethanone
CID 134056686
[4-[(2-ethyl-1,3-thiazol-4-yl)methyl]piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone;dihydrochloride
CID 119864358
2-amino-1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-2-methylpropan-1-one;dihydrochloride
CID 119837375
2-ethoxy-1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]propan-1-one
CID 51080863
1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-4-(methylamino)butan-1-one
CID 119837382
methyl (2S)-2-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]propanoate
CID 94393972
3-amino-1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-2-methylbutan-1-one
CID 120502657
1-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-4-(methylamino)butan-1-one;dihydrochloride
CID 119837381
ethyl 2-[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]acetate
CID 134031725

Frequently Asked Questions

What is the IUPAC name of [4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone?
The IUPAC name of [4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone (CID 119837434) is [4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone.
What is the SMILES notation for [4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone?
The canonical SMILES for [4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone is COC1(C(=O)N2CCN(Cc3cn4ccccc4n3)CC2)CCNCC1.
What is the InChIKey of [4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone?
The InChIKey is ZGBHHQDEWRRFKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O2/c1-26-19(5-7-20-8-6-19)18(25)23-12-10-22(11-13-23)14-16-15-24-9-3-2-4-17(24)21-16/h2-4,9,15,20H,5-8,10-14H2,1H3.
What are the key properties of [4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone?
[4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone has a molecular weight of 357.46 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(imidazo[1,2-a]pyridin-2-ylmethyl)piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone is sourced from PubChem (CID 119837434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).