N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine

C20H23N7O2 — CID 134192165

IUPACN-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESCn1nc(OCCN2CCOCC2)c2ccc(Nc3n[nH]c4cccnc34)cc21
InChIInChI=1S/C20H23N7O2/c1-26-17-13-14(22-19-18-16(23-24-19)3-2-6-21-18)4-5-15(17)20(25-26)29-12-9-27-7-10-28-11-8-27/h2-6,13H,7-12H2,1H3,(H2,22,23,24)
InChIKeyHJTCUFNFUCIKIM-UHFFFAOYSA-N
MW393.45 g/mol
LogP2.30
Rot. Bonds6

About N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine

N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine (PubChem CID 134192165) has the molecular formula C20H23N7O2 and a molecular weight of 393.45 g/mol. Its IUPAC name is N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine.

Molecular Properties

Compound NameN-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
PubChem CID134192165
Molecular FormulaC20H23N7O2
Molecular Weight393.45 g/mol
Exact Mass393.19
IUPAC NameN-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESCn1nc(OCCN2CCOCC2)c2ccc(Nc3n[nH]c4cccnc34)cc21
InChIInChI=1S/C20H23N7O2/c1-26-17-13-14(22-19-18-16(23-24-19)3-2-6-21-18)4-5-15(17)20(25-26)29-12-9-27-7-10-28-11-8-27/h2-6,13H,7-12H2,1H3,(H2,22,23,24)
InChIKeyHJTCUFNFUCIKIM-UHFFFAOYSA-N
XLogP2.30
TPSA93.12 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.45
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The IUPAC name of N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine (CID 134192165) is N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine.
What is the SMILES notation for N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The canonical SMILES for N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine is Cn1nc(OCCN2CCOCC2)c2ccc(Nc3n[nH]c4cccnc34)cc21.
What is the InChIKey of N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The InChIKey is HJTCUFNFUCIKIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N7O2/c1-26-17-13-14(22-19-18-16(23-24-19)3-2-6-21-18)4-5-15(17)20(25-26)29-12-9-27-7-10-28-11-8-27/h2-6,13H,7-12H2,1H3,(H2,22,23,24).
What are the key properties of N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine has a molecular weight of 393.45 g/mol, XLogP of 2.30, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-methyl-3-(2-morpholin-4-ylethoxy)indazol-6-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine is sourced from PubChem (CID 134192165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).