3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine

C25H21N5O — CID 126472598

IUPAC3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESc1ccc(Oc2ccccc2-c2cnc3c(NCCc4cccnc4)nccn23)cc1
InChIInChI=1S/C25H21N5O/c1-2-8-20(9-3-1)31-23-11-5-4-10-21(23)22-18-29-25-24(28-15-16-30(22)25)27-14-12-19-7-6-13-26-17-19/h1-11,13,15-18H,12,14H2,(H,27,28)
InChIKeyRLHDJAJVVJCTPE-UHFFFAOYSA-N
MW407.48 g/mol
LogP5.24
Rot. Bonds7

About 3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine

3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 126472598) has the molecular formula C25H21N5O and a molecular weight of 407.48 g/mol. Its IUPAC name is 3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID126472598
Molecular FormulaC25H21N5O
Molecular Weight407.48 g/mol
Exact Mass407.17
IUPAC Name3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESc1ccc(Oc2ccccc2-c2cnc3c(NCCc4cccnc4)nccn23)cc1
InChIInChI=1S/C25H21N5O/c1-2-8-20(9-3-1)31-23-11-5-4-10-21(23)22-18-29-25-24(28-15-16-30(22)25)27-14-12-19-7-6-13-26-17-19/h1-11,13,15-18H,12,14H2,(H,27,28)
InChIKeyRLHDJAJVVJCTPE-UHFFFAOYSA-N
XLogP5.24
TPSA64.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.48
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine (CID 126472598) is 3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine is c1ccc(Oc2ccccc2-c2cnc3c(NCCc4cccnc4)nccn23)cc1.
What is the InChIKey of 3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is RLHDJAJVVJCTPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N5O/c1-2-8-20(9-3-1)31-23-11-5-4-10-21(23)22-18-29-25-24(28-15-16-30(22)25)27-14-12-19-7-6-13-26-17-19/h1-11,13,15-18H,12,14H2,(H,27,28).
What are the key properties of 3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine?
3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 407.48 g/mol, XLogP of 5.24, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-phenoxyphenyl)-N-(2-pyridin-3-ylethyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 126472598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).