N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine

C15H13ClN6O — CID 134192157

IUPACN-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESCOc1nn(C)c2cc(Nc3n[nH]c4cccnc34)cc(Cl)c12
InChIInChI=1S/C15H13ClN6O/c1-22-11-7-8(6-9(16)12(11)15(21-22)23-2)18-14-13-10(19-20-14)4-3-5-17-13/h3-7H,1-2H3,(H2,18,19,20)
InChIKeyVPANDJLMVYLOQU-UHFFFAOYSA-N
MW328.76 g/mol
LogP3.25
Rot. Bonds3

About N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine

N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine (PubChem CID 134192157) has the molecular formula C15H13ClN6O and a molecular weight of 328.76 g/mol. Its IUPAC name is N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine.

Molecular Properties

Compound NameN-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine
PubChem CID134192157
Molecular FormulaC15H13ClN6O
Molecular Weight328.76 g/mol
Exact Mass328.08
IUPAC NameN-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESCOc1nn(C)c2cc(Nc3n[nH]c4cccnc34)cc(Cl)c12
InChIInChI=1S/C15H13ClN6O/c1-22-11-7-8(6-9(16)12(11)15(21-22)23-2)18-14-13-10(19-20-14)4-3-5-17-13/h3-7H,1-2H3,(H2,18,19,20)
InChIKeyVPANDJLMVYLOQU-UHFFFAOYSA-N
XLogP3.25
TPSA80.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.76
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine?
The IUPAC name of N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine (CID 134192157) is N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine.
What is the SMILES notation for N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine?
The canonical SMILES for N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine is COc1nn(C)c2cc(Nc3n[nH]c4cccnc34)cc(Cl)c12.
What is the InChIKey of N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine?
The InChIKey is VPANDJLMVYLOQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN6O/c1-22-11-7-8(6-9(16)12(11)15(21-22)23-2)18-14-13-10(19-20-14)4-3-5-17-13/h3-7H,1-2H3,(H2,18,19,20).
What are the key properties of N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine?
N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine has a molecular weight of 328.76 g/mol, XLogP of 3.25, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-methoxy-1-methylindazol-6-yl)-1H-pyrazolo[4,3-b]pyridin-3-amine is sourced from PubChem (CID 134192157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).