7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine

C11H10N4O — CID 667631

IUPAC7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine
SMILESCOc1ccc2cc3c(N)[nH]nc3nc2c1
InChIInChI=1S/C11H10N4O/c1-16-7-3-2-6-4-8-10(12)14-15-11(8)13-9(6)5-7/h2-5H,1H3,(H3,12,13,14,15)
InChIKeyQLIPUPSGLWIGAQ-UHFFFAOYSA-N
MW214.23 g/mol
LogP1.70
Rot. Bonds1

About 7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine

7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine (PubChem CID 667631) has the molecular formula C11H10N4O and a molecular weight of 214.23 g/mol. Its IUPAC name is 7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine.

Molecular Properties

Compound Name7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine
PubChem CID667631
Molecular FormulaC11H10N4O
Molecular Weight214.23 g/mol
Exact Mass214.09
IUPAC Name7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine
SMILESCOc1ccc2cc3c(N)[nH]nc3nc2c1
InChIInChI=1S/C11H10N4O/c1-16-7-3-2-6-4-8-10(12)14-15-11(8)13-9(6)5-7/h2-5H,1H3,(H3,12,13,14,15)
InChIKeyQLIPUPSGLWIGAQ-UHFFFAOYSA-N
XLogP1.70
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

CID 754731
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CID 75277381
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CID 75277379
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CID 16195356
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CID 16195403
CID 16195403
CID 738352
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CID 3244716
CID 3244716
CID 1276764
CID 1276764
CID 3566059
CID 3566059
CID 9901505
CID 9901505
CID 10269139
CID 10269139
CID 11510421
CID 11510421

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine?
The IUPAC name of 7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine (CID 667631) is 7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine.
What is the SMILES notation for 7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine?
The canonical SMILES for 7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine is COc1ccc2cc3c(N)[nH]nc3nc2c1.
What is the InChIKey of 7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine?
The InChIKey is QLIPUPSGLWIGAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O/c1-16-7-3-2-6-4-8-10(12)14-15-11(8)13-9(6)5-7/h2-5H,1H3,(H3,12,13,14,15).
What are the key properties of 7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine?
7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine has a molecular weight of 214.23 g/mol, XLogP of 1.70, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2H-pyrazolo[3,4-b]quinolin-3-amine is sourced from PubChem (CID 667631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).