N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine

C17H17ClN6 — CID 134192183

IUPACN-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESCC(C)Cn1nc(Cl)c2cc(Nc3n[nH]c4cccnc34)ccc21
InChIInChI=1S/C17H17ClN6/c1-10(2)9-24-14-6-5-11(8-12(14)16(18)23-24)20-17-15-13(21-22-17)4-3-7-19-15/h3-8,10H,9H2,1-2H3,(H2,20,21,22)
InChIKeyUFJCFRVNFWBSBY-UHFFFAOYSA-N
MW340.82 g/mol
LogP4.36
Rot. Bonds4

About N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine

N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine (PubChem CID 134192183) has the molecular formula C17H17ClN6 and a molecular weight of 340.82 g/mol. Its IUPAC name is N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine.

Molecular Properties

Compound NameN-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
PubChem CID134192183
Molecular FormulaC17H17ClN6
Molecular Weight340.82 g/mol
Exact Mass340.12
IUPAC NameN-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESCC(C)Cn1nc(Cl)c2cc(Nc3n[nH]c4cccnc34)ccc21
InChIInChI=1S/C17H17ClN6/c1-10(2)9-24-14-6-5-11(8-12(14)16(18)23-24)20-17-15-13(21-22-17)4-3-7-19-15/h3-8,10H,9H2,1-2H3,(H2,20,21,22)
InChIKeyUFJCFRVNFWBSBY-UHFFFAOYSA-N
XLogP4.36
TPSA71.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.82
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The IUPAC name of N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine (CID 134192183) is N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine.
What is the SMILES notation for N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The canonical SMILES for N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine is CC(C)Cn1nc(Cl)c2cc(Nc3n[nH]c4cccnc34)ccc21.
What is the InChIKey of N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The InChIKey is UFJCFRVNFWBSBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN6/c1-10(2)9-24-14-6-5-11(8-12(14)16(18)23-24)20-17-15-13(21-22-17)4-3-7-19-15/h3-8,10H,9H2,1-2H3,(H2,20,21,22).
What are the key properties of N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine has a molecular weight of 340.82 g/mol, XLogP of 4.36, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-1-(2-methylpropyl)indazol-5-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine is sourced from PubChem (CID 134192183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).