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

C19H23N5O2 — CID 154640933

IUPAC5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine
SMILESCOc1cncc(-c2cc(N[C@@H]3CCOC3)c3c(cnn3C(C)C)n2)c1
InChIInChI=1S/C19H23N5O2/c1-12(2)24-19-17(22-14-4-5-26-11-14)7-16(23-18(19)10-21-24)13-6-15(25-3)9-20-8-13/h6-10,12,14H,4-5,11H2,1-3H3,(H,22,23)/t14-/m1/s1
InChIKeyCVIGMQFSENBFLC-CQSZACIVSA-N
MW353.43 g/mol
LogP3.28
Rot. Bonds5

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

5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine (PubChem CID 154640933) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is 5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine.

Molecular Properties

Compound Name5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine
PubChem CID154640933
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine
SMILESCOc1cncc(-c2cc(N[C@@H]3CCOC3)c3c(cnn3C(C)C)n2)c1
InChIInChI=1S/C19H23N5O2/c1-12(2)24-19-17(22-14-4-5-26-11-14)7-16(23-18(19)10-21-24)13-6-15(25-3)9-20-8-13/h6-10,12,14H,4-5,11H2,1-3H3,(H,22,23)/t14-/m1/s1
InChIKeyCVIGMQFSENBFLC-CQSZACIVSA-N
XLogP3.28
TPSA74.09 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine?
The IUPAC name of 5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine (CID 154640933) is 5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine.
What is the SMILES notation for 5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine?
The canonical SMILES for 5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine is COc1cncc(-c2cc(N[C@@H]3CCOC3)c3c(cnn3C(C)C)n2)c1.
What is the InChIKey of 5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine?
The InChIKey is CVIGMQFSENBFLC-CQSZACIVSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-12(2)24-19-17(22-14-4-5-26-11-14)7-16(23-18(19)10-21-24)13-6-15(25-3)9-20-8-13/h6-10,12,14H,4-5,11H2,1-3H3,(H,22,23)/t14-/m1/s1.
What are the key properties of 5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine?
5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine has a molecular weight of 353.43 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-methoxy-3-pyridinyl)-N-[(3R)-oxolan-3-yl]-1-propan-2-ylpyrazolo[4,5-b]pyridin-7-amine is sourced from PubChem (CID 154640933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).