3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline

C15H16N4 — CID 90909036

IUPAC3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline
SMILESCCc1nc(-c2cccc(N)c2C)cn2ccnc12
InChIInChI=1S/C15H16N4/c1-3-13-15-17-7-8-19(15)9-14(18-13)11-5-4-6-12(16)10(11)2/h4-9H,3,16H2,1-2H3
InChIKeyZUOZBHADTGOWRR-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.85
Rot. Bonds2

About 3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline

3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline (PubChem CID 90909036) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is 3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline.

Molecular Properties

Compound Name3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline
PubChem CID90909036
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC Name3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline
SMILESCCc1nc(-c2cccc(N)c2C)cn2ccnc12
InChIInChI=1S/C15H16N4/c1-3-13-15-17-7-8-19(15)9-14(18-13)11-5-4-6-12(16)10(11)2/h4-9H,3,16H2,1-2H3
InChIKeyZUOZBHADTGOWRR-UHFFFAOYSA-N
XLogP2.85
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline?
The IUPAC name of 3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline (CID 90909036) is 3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline.
What is the SMILES notation for 3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline?
The canonical SMILES for 3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline is CCc1nc(-c2cccc(N)c2C)cn2ccnc12.
What is the InChIKey of 3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline?
The InChIKey is ZUOZBHADTGOWRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-3-13-15-17-7-8-19(15)9-14(18-13)11-5-4-6-12(16)10(11)2/h4-9H,3,16H2,1-2H3.
What are the key properties of 3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline?
3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline has a molecular weight of 252.32 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-ethylimidazo[1,2-a]pyrazin-6-yl)-2-methylaniline is sourced from PubChem (CID 90909036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).