4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole

C19H18N4 — CID 57380255

IUPAC4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole
SMILESCCn1c(-c2ccccc2)nc2c1c(C)nn2-c1ccccc1
InChIInChI=1S/C19H18N4/c1-3-22-17-14(2)21-23(16-12-8-5-9-13-16)19(17)20-18(22)15-10-6-4-7-11-15/h4-13H,3H2,1-2H3
InChIKeyGMWKMAVDVBZYLH-UHFFFAOYSA-N
MW302.38 g/mol
LogP4.22
Rot. Bonds3

About 4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole

4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole (PubChem CID 57380255) has the molecular formula C19H18N4 and a molecular weight of 302.38 g/mol. Its IUPAC name is 4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole.

Molecular Properties

Compound Name4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole
PubChem CID57380255
Molecular FormulaC19H18N4
Molecular Weight302.38 g/mol
Exact Mass302.15
IUPAC Name4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole
SMILESCCn1c(-c2ccccc2)nc2c1c(C)nn2-c1ccccc1
InChIInChI=1S/C19H18N4/c1-3-22-17-14(2)21-23(16-12-8-5-9-13-16)19(17)20-18(22)15-10-6-4-7-11-15/h4-13H,3H2,1-2H3
InChIKeyGMWKMAVDVBZYLH-UHFFFAOYSA-N
XLogP4.22
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole?
The IUPAC name of 4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole (CID 57380255) is 4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole.
What is the SMILES notation for 4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole?
The canonical SMILES for 4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole is CCn1c(-c2ccccc2)nc2c1c(C)nn2-c1ccccc1.
What is the InChIKey of 4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole?
The InChIKey is GMWKMAVDVBZYLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4/c1-3-22-17-14(2)21-23(16-12-8-5-9-13-16)19(17)20-18(22)15-10-6-4-7-11-15/h4-13H,3H2,1-2H3.
What are the key properties of 4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole?
4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole has a molecular weight of 302.38 g/mol, XLogP of 4.22, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-methyl-1,5-diphenylimidazo[4,5-d]pyrazole is sourced from PubChem (CID 57380255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).