7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine

C18H16N4 — CID 22417855

IUPAC7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine
SMILESCc1ccc(Nc2cc(C)nc3ccc4cn[nH]c4c23)cc1
InChIInChI=1S/C18H16N4/c1-11-3-6-14(7-4-11)21-16-9-12(2)20-15-8-5-13-10-19-22-18(13)17(15)16/h3-10H,1-2H3,(H,19,22)(H,20,21)
InChIKeyRNRRFCMYQZJBHU-UHFFFAOYSA-N
MW288.35 g/mol
LogP4.47
Rot. Bonds2

About 7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine

7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine (PubChem CID 22417855) has the molecular formula C18H16N4 and a molecular weight of 288.35 g/mol. Its IUPAC name is 7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine.

Molecular Properties

Compound Name7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine
PubChem CID22417855
Molecular FormulaC18H16N4
Molecular Weight288.35 g/mol
Exact Mass288.14
IUPAC Name7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine
SMILESCc1ccc(Nc2cc(C)nc3ccc4cn[nH]c4c23)cc1
InChIInChI=1S/C18H16N4/c1-11-3-6-14(7-4-11)21-16-9-12(2)20-15-8-5-13-10-19-22-18(13)17(15)16/h3-10H,1-2H3,(H,19,22)(H,20,21)
InChIKeyRNRRFCMYQZJBHU-UHFFFAOYSA-N
XLogP4.47
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine?
The IUPAC name of 7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine (CID 22417855) is 7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine.
What is the SMILES notation for 7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine?
The canonical SMILES for 7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine is Cc1ccc(Nc2cc(C)nc3ccc4cn[nH]c4c23)cc1.
What is the InChIKey of 7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine?
The InChIKey is RNRRFCMYQZJBHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4/c1-11-3-6-14(7-4-11)21-16-9-12(2)20-15-8-5-13-10-19-22-18(13)17(15)16/h3-10H,1-2H3,(H,19,22)(H,20,21).
What are the key properties of 7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine?
7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine has a molecular weight of 288.35 g/mol, XLogP of 4.47, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-N-(4-methylphenyl)-1H-pyrazolo[5,4-f]quinolin-9-amine is sourced from PubChem (CID 22417855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).