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

C10H7ClN4 — CID 22334609

IUPAC7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine
SMILESNc1[nH]nc2nc3cc(Cl)ccc3cc12
InChIInChI=1S/C10H7ClN4/c11-6-2-1-5-3-7-9(12)14-15-10(7)13-8(5)4-6/h1-4H,(H3,12,13,14,15)
InChIKeySAPWXFJDVCRSKW-UHFFFAOYSA-N
MW218.65 g/mol
LogP2.35
Rot. Bonds

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

7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine (PubChem CID 22334609) has the molecular formula C10H7ClN4 and a molecular weight of 218.65 g/mol. Its IUPAC name is 7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine.

Molecular Properties

Compound Name7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine
PubChem CID22334609
Molecular FormulaC10H7ClN4
Molecular Weight218.65 g/mol
Exact Mass218.04
IUPAC Name7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine
SMILESNc1[nH]nc2nc3cc(Cl)ccc3cc12
InChIInChI=1S/C10H7ClN4/c11-6-2-1-5-3-7-9(12)14-15-10(7)13-8(5)4-6/h1-4H,(H3,12,13,14,15)
InChIKeySAPWXFJDVCRSKW-UHFFFAOYSA-N
XLogP2.35
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.65
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

7-chloro-2-methylquinolin-3-amine
CID 72942962
5-chloro-13-phenyl-2,12,14,15,17-pentazatetracyclo[8.7.0.03,8.012,16]heptadeca-1(10),2,4,6,8,13,16-heptaen-11-one
CID 139236333
7-chloroquinazolin-2-amine
CID 10678921
3,10-dichloroquinolino[2,3-c]cinnoline
CID 134997494
5-fluoro-6-N-(2-fluoro-5-methylphenyl)-2H-pyrazolo[3,4-b]pyridine-3,6-diamine
CID 164844279
6-N-(2-chloro-3-methylphenyl)-5-fluoro-2H-pyrazolo[3,4-b]pyridine-3,6-diamine
CID 164844282
8-chloro-1H-pyrazolo[4,3-c]quinolin-3-amine
CID 50877641
2,3,8-trichloroquinoxalino[2,3-b]quinoxaline
CID 101466553
2,7-dichloro-3-(dichloromethyl)quinoline
CID 15142733
3-bromo-7-chloro-2-methylquinoline
CID 151670813
4-[(5-chloro-2-fluorophenyl)diazenyl]-1H-pyrazole-3,5-diamine
CID 135525489
azane;4-chlorocyclopropa[b]indole
CID 174412946

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine?
The IUPAC name of 7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine (CID 22334609) is 7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine.
What is the SMILES notation for 7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine?
The canonical SMILES for 7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine is Nc1[nH]nc2nc3cc(Cl)ccc3cc12.
What is the InChIKey of 7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine?
The InChIKey is SAPWXFJDVCRSKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClN4/c11-6-2-1-5-3-7-9(12)14-15-10(7)13-8(5)4-6/h1-4H,(H3,12,13,14,15).
What are the key properties of 7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine?
7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine has a molecular weight of 218.65 g/mol, XLogP of 2.35, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2H-pyrazolo[3,4-b]quinolin-3-amine is sourced from PubChem (CID 22334609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).