5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine

C20H25N5O2 — CID 142608497

IUPAC5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine
SMILESCCCn1ncc2nc(-c3cccnc3OCC)cc(N[C@@H]3CCOC3)c21
InChIInChI=1S/C20H25N5O2/c1-3-9-25-19-17(23-14-7-10-26-13-14)11-16(24-18(19)12-22-25)15-6-5-8-21-20(15)27-4-2/h5-6,8,11-12,14H,3-4,7,9-10,13H2,1-2H3,(H,23,24)/t14-/m1/s1
InChIKeyLXIXZJSFHDNFEZ-CQSZACIVSA-N
MW367.45 g/mol
LogP3.50
Rot. Bonds7

About 5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine

5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine (PubChem CID 142608497) has the molecular formula C20H25N5O2 and a molecular weight of 367.45 g/mol. Its IUPAC name is 5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine.

Molecular Properties

Compound Name5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine
PubChem CID142608497
Molecular FormulaC20H25N5O2
Molecular Weight367.45 g/mol
Exact Mass367.20
IUPAC Name5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine
SMILESCCCn1ncc2nc(-c3cccnc3OCC)cc(N[C@@H]3CCOC3)c21
InChIInChI=1S/C20H25N5O2/c1-3-9-25-19-17(23-14-7-10-26-13-14)11-16(24-18(19)12-22-25)15-6-5-8-21-20(15)27-4-2/h5-6,8,11-12,14H,3-4,7,9-10,13H2,1-2H3,(H,23,24)/t14-/m1/s1
InChIKeyLXIXZJSFHDNFEZ-CQSZACIVSA-N
XLogP3.50
TPSA74.09 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine?
The IUPAC name of 5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine (CID 142608497) is 5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine.
What is the SMILES notation for 5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine?
The canonical SMILES for 5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine is CCCn1ncc2nc(-c3cccnc3OCC)cc(N[C@@H]3CCOC3)c21.
What is the InChIKey of 5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine?
The InChIKey is LXIXZJSFHDNFEZ-CQSZACIVSA-N. The full InChI is InChI=1S/C20H25N5O2/c1-3-9-25-19-17(23-14-7-10-26-13-14)11-16(24-18(19)12-22-25)15-6-5-8-21-20(15)27-4-2/h5-6,8,11-12,14H,3-4,7,9-10,13H2,1-2H3,(H,23,24)/t14-/m1/s1.
What are the key properties of 5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine?
5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine has a molecular weight of 367.45 g/mol, XLogP of 3.50, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propylpyrazolo[4,5-b]pyridin-7-amine is sourced from PubChem (CID 142608497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).