N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine

C16H18N4O2 — CID 46241898

IUPACN-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOCCNc1nccn2c(-c3cccc(OC)c3)cnc12
InChIInChI=1S/C16H18N4O2/c1-21-9-7-18-15-16-19-11-14(20(16)8-6-17-15)12-4-3-5-13(10-12)22-2/h3-6,8,10-11H,7,9H2,1-2H3,(H,17,18)
InChIKeyDFJQFBXVILQNOE-UHFFFAOYSA-N
MW298.35 g/mol
LogP2.46
Rot. Bonds6

About N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine

N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 46241898) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID46241898
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC NameN-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOCCNc1nccn2c(-c3cccc(OC)c3)cnc12
InChIInChI=1S/C16H18N4O2/c1-21-9-7-18-15-16-19-11-14(20(16)8-6-17-15)12-4-3-5-13(10-12)22-2/h3-6,8,10-11H,7,9H2,1-2H3,(H,17,18)
InChIKeyDFJQFBXVILQNOE-UHFFFAOYSA-N
XLogP2.46
TPSA60.68 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine (CID 46241898) is N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine is COCCNc1nccn2c(-c3cccc(OC)c3)cnc12.
What is the InChIKey of N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is DFJQFBXVILQNOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c1-21-9-7-18-15-16-19-11-14(20(16)8-6-17-15)12-4-3-5-13(10-12)22-2/h3-6,8,10-11H,7,9H2,1-2H3,(H,17,18).
What are the key properties of N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine?
N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 298.35 g/mol, XLogP of 2.46, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-(3-methoxyphenyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 46241898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).