[4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone

C20H22N4O2 — CID 87051370

IUPAC[4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone
SMILESCOc1cccc(N2CCN(C(=O)c3cn4cccc(C)c4n3)CC2)c1
InChIInChI=1S/C20H22N4O2/c1-15-5-4-8-24-14-18(21-19(15)24)20(25)23-11-9-22(10-12-23)16-6-3-7-17(13-16)26-2/h3-8,13-14H,9-12H2,1-2H3
InChIKeyMHDNMPJMLFCWII-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.61
Rot. Bonds3

About [4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone

[4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone (PubChem CID 87051370) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is [4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone.

Molecular Properties

Compound Name[4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone
PubChem CID87051370
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name[4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone
SMILESCOc1cccc(N2CCN(C(=O)c3cn4cccc(C)c4n3)CC2)c1
InChIInChI=1S/C20H22N4O2/c1-15-5-4-8-24-14-18(21-19(15)24)20(25)23-11-9-22(10-12-23)16-6-3-7-17(13-16)26-2/h3-8,13-14H,9-12H2,1-2H3
InChIKeyMHDNMPJMLFCWII-UHFFFAOYSA-N
XLogP2.61
TPSA50.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The IUPAC name of [4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone (CID 87051370) is [4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone.
What is the SMILES notation for [4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The canonical SMILES for [4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone is COc1cccc(N2CCN(C(=O)c3cn4cccc(C)c4n3)CC2)c1.
What is the InChIKey of [4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone?
The InChIKey is MHDNMPJMLFCWII-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-15-5-4-8-24-14-18(21-19(15)24)20(25)23-11-9-22(10-12-23)16-6-3-7-17(13-16)26-2/h3-8,13-14H,9-12H2,1-2H3.
What are the key properties of [4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone?
[4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone has a molecular weight of 350.42 g/mol, XLogP of 2.61, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-methoxyphenyl)piperazin-1-yl]-(8-methylimidazo[1,2-a]pyridin-2-yl)methanone is sourced from PubChem (CID 87051370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).