imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone

C16H18N6O — CID 120877946

IUPACimidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone
SMILESCn1ccnc1C1CNCCN1C(=O)c1cn2ccccc2n1
InChIInChI=1S/C16H18N6O/c1-20-8-6-18-15(20)13-10-17-5-9-22(13)16(23)12-11-21-7-3-2-4-14(21)19-12/h2-4,6-8,11,13,17H,5,9-10H2,1H3
InChIKeyFTHBWUFFOHISAS-UHFFFAOYSA-N
MW310.36 g/mol
LogP0.85
Rot. Bonds2

About imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone

imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone (PubChem CID 120877946) has the molecular formula C16H18N6O and a molecular weight of 310.36 g/mol. Its IUPAC name is imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone.

Molecular Properties

Compound Nameimidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone
PubChem CID120877946
Molecular FormulaC16H18N6O
Molecular Weight310.36 g/mol
Exact Mass310.15
IUPAC Nameimidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone
SMILESCn1ccnc1C1CNCCN1C(=O)c1cn2ccccc2n1
InChIInChI=1S/C16H18N6O/c1-20-8-6-18-15(20)13-10-17-5-9-22(13)16(23)12-11-21-7-3-2-4-14(21)19-12/h2-4,6-8,11,13,17H,5,9-10H2,1H3
InChIKeyFTHBWUFFOHISAS-UHFFFAOYSA-N
XLogP0.85
TPSA67.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[2-(1-methylimidazol-2-yl)piperazin-1-yl]-(1-methylpyrrol-2-yl)methanone;hydrochloride
CID 120879273
[2-(1-methylimidazol-2-yl)piperazin-1-yl]-(4-methylphenyl)methanone
CID 120878912
[2-(1-methylimidazol-2-yl)piperazin-1-yl]-(1H-pyrrol-2-yl)methanone;hydrochloride
CID 120878125
imidazo[1,2-a]pyrazin-8-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone
CID 120878426
1-benzofuran-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone;hydrochloride
CID 120877663
1-benzothiophen-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone;hydrochloride
CID 120878121
[2-(1-methylimidazol-2-yl)piperazin-1-yl]-pyridin-3-ylmethanone;dihydrochloride
CID 120878927
[2-(1-methylimidazol-2-yl)piperazin-1-yl]-(2,2,3,3-tetramethylcyclopropyl)methanone
CID 120879634
1,3-dimethyl-7-[2-(1-methylimidazol-2-yl)piperazine-1-carbonyl]pyrido[2,3-d]pyrimidine-2,4-dione
CID 120879994
[2-(1-methylimidazol-2-yl)piperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone
CID 120877640
[2-(1-methylimidazol-2-yl)piperazin-1-yl]-(2-methylquinolin-4-yl)methanone;dihydrochloride
CID 120880759
[2-(1-methylimidazol-2-yl)piperazin-1-yl]-[1-(4-methylphenyl)triazol-4-yl]methanone;hydrochloride
CID 120877565

Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone?
The IUPAC name of imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone (CID 120877946) is imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone.
What is the SMILES notation for imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone?
The canonical SMILES for imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone is Cn1ccnc1C1CNCCN1C(=O)c1cn2ccccc2n1.
What is the InChIKey of imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone?
The InChIKey is FTHBWUFFOHISAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N6O/c1-20-8-6-18-15(20)13-10-17-5-9-22(13)16(23)12-11-21-7-3-2-4-14(21)19-12/h2-4,6-8,11,13,17H,5,9-10H2,1H3.
What are the key properties of imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone?
imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone has a molecular weight of 310.36 g/mol, XLogP of 0.85, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-a]pyridin-2-yl-[2-(1-methylimidazol-2-yl)piperazin-1-yl]methanone is sourced from PubChem (CID 120877946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).