5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one

C17H17N5O — CID 58601148

IUPAC5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one
SMILESCCn1c(=O)c2c(C)[nH]nc2c2cc(-c3cnn(C)c3)ccc21
InChIInChI=1S/C17H17N5O/c1-4-22-14-6-5-11(12-8-18-21(3)9-12)7-13(14)16-15(17(22)23)10(2)19-20-16/h5-9H,4H2,1-3H3,(H,19,20)
InChIKeyWEHRINBCBPWJQH-UHFFFAOYSA-N
MW307.36 g/mol
LogP2.61
Rot. Bonds2

About 5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one

5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one (PubChem CID 58601148) has the molecular formula C17H17N5O and a molecular weight of 307.36 g/mol. Its IUPAC name is 5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

Compound Name5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one
PubChem CID58601148
Molecular FormulaC17H17N5O
Molecular Weight307.36 g/mol
Exact Mass307.14
IUPAC Name5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one
SMILESCCn1c(=O)c2c(C)[nH]nc2c2cc(-c3cnn(C)c3)ccc21
InChIInChI=1S/C17H17N5O/c1-4-22-14-6-5-11(12-8-18-21(3)9-12)7-13(14)16-15(17(22)23)10(2)19-20-16/h5-9H,4H2,1-3H3,(H,19,20)
InChIKeyWEHRINBCBPWJQH-UHFFFAOYSA-N
XLogP2.61
TPSA68.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.36
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one 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 5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one?
The IUPAC name of 5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one (CID 58601148) is 5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one.
What is the SMILES notation for 5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one?
The canonical SMILES for 5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one is CCn1c(=O)c2c(C)[nH]nc2c2cc(-c3cnn(C)c3)ccc21.
What is the InChIKey of 5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one?
The InChIKey is WEHRINBCBPWJQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5O/c1-4-22-14-6-5-11(12-8-18-21(3)9-12)7-13(14)16-15(17(22)23)10(2)19-20-16/h5-9H,4H2,1-3H3,(H,19,20).
What are the key properties of 5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one?
5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one has a molecular weight of 307.36 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-methyl-8-(1-methylpyrazol-4-yl)-2H-pyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 58601148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).