N-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine

C18H21N5O — CID 154640926

IUPACN-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine
SMILESCC(C)n1ncc2nc(-c3cccnc3)cc(N[C@@H]3CCOC3)c21
InChIInChI=1S/C18H21N5O/c1-12(2)23-18-16(21-14-5-7-24-11-14)8-15(22-17(18)10-20-23)13-4-3-6-19-9-13/h3-4,6,8-10,12,14H,5,7,11H2,1-2H3,(H,21,22)/t14-/m1/s1
InChIKeyZZEWGRHZCLIBAB-CQSZACIVSA-N
MW323.40 g/mol
LogP3.28
Rot. Bonds4

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

N-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine (PubChem CID 154640926) has the molecular formula C18H21N5O and a molecular weight of 323.40 g/mol. Its IUPAC name is N-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine.

Molecular Properties

Compound NameN-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine
PubChem CID154640926
Molecular FormulaC18H21N5O
Molecular Weight323.40 g/mol
Exact Mass323.17
IUPAC NameN-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine
SMILESCC(C)n1ncc2nc(-c3cccnc3)cc(N[C@@H]3CCOC3)c21
InChIInChI=1S/C18H21N5O/c1-12(2)23-18-16(21-14-5-7-24-11-14)8-15(22-17(18)10-20-23)13-4-3-6-19-9-13/h3-4,6,8-10,12,14H,5,7,11H2,1-2H3,(H,21,22)/t14-/m1/s1
InChIKeyZZEWGRHZCLIBAB-CQSZACIVSA-N
XLogP3.28
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine?
The IUPAC name of N-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine (CID 154640926) is N-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine.
What is the SMILES notation for N-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine?
The canonical SMILES for N-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine is CC(C)n1ncc2nc(-c3cccnc3)cc(N[C@@H]3CCOC3)c21.
What is the InChIKey of N-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine?
The InChIKey is ZZEWGRHZCLIBAB-CQSZACIVSA-N. The full InChI is InChI=1S/C18H21N5O/c1-12(2)23-18-16(21-14-5-7-24-11-14)8-15(22-17(18)10-20-23)13-4-3-6-19-9-13/h3-4,6,8-10,12,14H,5,7,11H2,1-2H3,(H,21,22)/t14-/m1/s1.
What are the key properties of N-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine?
N-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine has a molecular weight of 323.40 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-oxolan-3-yl]-1-propan-2-yl-5-pyridin-3-ylpyrazolo[4,5-b]pyridin-7-amine is sourced from PubChem (CID 154640926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).