1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine

C16H16N4 — CID 665899

IUPAC1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine
SMILESCc1[nH]nc2c1-c1nc3ccccc3nc1C(C)(C)C2
InChIInChI=1S/C16H16N4/c1-9-13-12(20-19-9)8-16(2,3)15-14(13)17-10-6-4-5-7-11(10)18-15/h4-7H,8H2,1-3H3,(H,19,20)
InChIKeyKIKPJKHJVSIAPJ-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.16
Rot. Bonds

About 1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine

1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine (PubChem CID 665899) has the molecular formula C16H16N4 and a molecular weight of 264.33 g/mol. Its IUPAC name is 1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine.

Molecular Properties

Compound Name1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine
PubChem CID665899
Molecular FormulaC16H16N4
Molecular Weight264.33 g/mol
Exact Mass264.14
IUPAC Name1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine
SMILESCc1[nH]nc2c1-c1nc3ccccc3nc1C(C)(C)C2
InChIInChI=1S/C16H16N4/c1-9-13-12(20-19-9)8-16(2,3)15-14(13)17-10-6-4-5-7-11(10)18-15/h4-7H,8H2,1-3H3,(H,19,20)
InChIKeyKIKPJKHJVSIAPJ-UHFFFAOYSA-N
XLogP3.16
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-N-(2-methylpropyl)-3-phenyl-1H-pyrazolo[4,3-b]pyridin-7-amine
CID 20040888
11H-Indolo[3,2-c]cinnoline
CID 5742808
US11242343, Example 4
CID 134327623
US11242343, Example 1
CID 134327695
2-[(E)-2-(1H-indazol-3-yl)ethenyl]-1-methylquinolin-1-ium-4-amine iodide
CID 71818682
2-[(E)-2-(1H-indazol-3-yl)vinyl]quinolin-4-amine
CID 71818825
2-N-(10H-indolo[3,2-b]quinolin-11-yl)benzene-1,2-diamine
CID 137658115
US11242343, Example 9
CID 134327916
3-Phenyl-5H-pyridazino[4,3-b]indole
CID 23648194
N-(4-tert-butylphenyl)-5-methyl-1H-pyrazolo[4,3-b]pyridin-7-amine;hydrochloride
CID 44522796
N-[11-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]indolo[3,2-b]quinolin-10-yl]-N',N'-dimethylpropane-1,3-diamine
CID 168287435
3-(4-fluorophenyl)-5,5-dimethyl-4,5-dihydro-3H-pyrazolo[4,3-a]phenazine
CID 729625

Frequently Asked Questions

What is the IUPAC name of 1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine?
The IUPAC name of 1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine (CID 665899) is 1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine.
What is the SMILES notation for 1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine?
The canonical SMILES for 1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine is Cc1[nH]nc2c1-c1nc3ccccc3nc1C(C)(C)C2.
What is the InChIKey of 1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine?
The InChIKey is KIKPJKHJVSIAPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4/c1-9-13-12(20-19-9)8-16(2,3)15-14(13)17-10-6-4-5-7-11(10)18-15/h4-7H,8H2,1-3H3,(H,19,20).
What are the key properties of 1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine?
1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine has a molecular weight of 264.33 g/mol, XLogP of 3.16, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,5-trimethyl-2,4-dihydropyrazolo[4,3-a]phenazine is sourced from PubChem (CID 665899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).