9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine

C17H22N4 — CID 68867828

IUPAC9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine
SMILESCCCn1cc2c(n1)c(N)nc1cccc(CC(C)C)c12
InChIInChI=1S/C17H22N4/c1-4-8-21-10-13-15-12(9-11(2)3)6-5-7-14(15)19-17(18)16(13)20-21/h5-7,10-11H,4,8-9H2,1-3H3,(H2,18,19)
InChIKeyFDQLOSPMJCYXCA-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.78
Rot. Bonds4

About 9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine

9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine (PubChem CID 68867828) has the molecular formula C17H22N4 and a molecular weight of 282.39 g/mol. Its IUPAC name is 9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine.

Molecular Properties

Compound Name9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine
PubChem CID68867828
Molecular FormulaC17H22N4
Molecular Weight282.39 g/mol
Exact Mass282.18
IUPAC Name9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine
SMILESCCCn1cc2c(n1)c(N)nc1cccc(CC(C)C)c12
InChIInChI=1S/C17H22N4/c1-4-8-21-10-13-15-12(9-11(2)3)6-5-7-14(15)19-17(18)16(13)20-21/h5-7,10-11H,4,8-9H2,1-3H3,(H2,18,19)
InChIKeyFDQLOSPMJCYXCA-UHFFFAOYSA-N
XLogP3.78
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine?
The IUPAC name of 9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine (CID 68867828) is 9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine.
What is the SMILES notation for 9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine?
The canonical SMILES for 9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine is CCCn1cc2c(n1)c(N)nc1cccc(CC(C)C)c12.
What is the InChIKey of 9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine?
The InChIKey is FDQLOSPMJCYXCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4/c1-4-8-21-10-13-15-12(9-11(2)3)6-5-7-14(15)19-17(18)16(13)20-21/h5-7,10-11H,4,8-9H2,1-3H3,(H2,18,19).
What are the key properties of 9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine?
9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine has a molecular weight of 282.39 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-methylpropyl)-2-propylpyrazolo[3,4-c]quinolin-4-amine is sourced from PubChem (CID 68867828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).