3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one

C14H15N3O — CID 143019646

IUPAC3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one
SMILESCCCn1c(=O)c2c(C)[nH]nc2c2ccccc21
InChIInChI=1S/C14H15N3O/c1-3-8-17-11-7-5-4-6-10(11)13-12(14(17)18)9(2)15-16-13/h4-7H,3,8H2,1-2H3,(H,15,16)
InChIKeyILTZDGPFEKJSIK-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.60
Rot. Bonds2

About 3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one

3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one (PubChem CID 143019646) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one.

Molecular Properties

Compound Name3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one
PubChem CID143019646
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one
SMILESCCCn1c(=O)c2c(C)[nH]nc2c2ccccc21
InChIInChI=1S/C14H15N3O/c1-3-8-17-11-7-5-4-6-10(11)13-12(14(17)18)9(2)15-16-13/h4-7H,3,8H2,1-2H3,(H,15,16)
InChIKeyILTZDGPFEKJSIK-UHFFFAOYSA-N
XLogP2.60
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-5-yl)propyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 91513865
1-methyl-5-propylimidazo[4,5-c]quinolin-4-one
CID 3077021
3-methyl-2H-phenanthro[9,10-c]pyrazole
CID 134820650
8-(3-aminopropyl)-5-methyl-3,4,8-triazatetracyclo[7.7.0.02,6.011,15]hexadeca-1(9),2,5,10,15-pentaen-7-one
CID 11666515
5-(3-aminopropyl)-3-methyl-8-(2-piperidin-1-ylethyl)-2H-pyrazolo[4,3-c]quinolin-4-one
CID 143019803
[(Z)-3-amino-2-[5-(3-aminopropyl)-3-methyl-4-oxo-2H-pyrazolo[4,3-c]quinolin-8-yl]prop-2-enylidene]azanium
CID 143019898
4-hydroxy-1,3-dipropylquinolin-2-one
CID 54703043
1-benzyl-5-propylimidazo[4,5-c]quinolin-4-one
CID 10448523
1,4-dimethyl-2H-pyrazolo[3,4-b]indole
CID 134515346
2-oxo-1-propylquinoline-4-carbaldehyde
CID 88586782
3-acetyl-4-hydroxy-1-propylquinolin-2-one
CID 54711259
10-methyl-2-phenyl-3-propylpyrimido[4,5-b]quinoline-4,5-dione
CID 4894058

Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one?
The IUPAC name of 3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one (CID 143019646) is 3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one.
What is the SMILES notation for 3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one?
The canonical SMILES for 3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one is CCCn1c(=O)c2c(C)[nH]nc2c2ccccc21.
What is the InChIKey of 3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one?
The InChIKey is ILTZDGPFEKJSIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-3-8-17-11-7-5-4-6-10(11)13-12(14(17)18)9(2)15-16-13/h4-7H,3,8H2,1-2H3,(H,15,16).
What are the key properties of 3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one?
3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one has a molecular weight of 241.29 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-propyl-2H-pyrazolo[4,3-c]quinolin-4-one is sourced from PubChem (CID 143019646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).