1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol

C25H26ClN5O3 — CID 134436432

IUPAC1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol
SMILESCC(C)(O)COc1cc(-c2ccc(N3CC[C@@H](Oc4ccccn4)C3)nc2)c2c(Cl)cnn2c1
InChIInChI=1S/C25H26ClN5O3/c1-25(2,32)16-33-19-11-20(24-21(26)13-29-31(24)15-19)17-6-7-22(28-12-17)30-10-8-18(14-30)34-23-5-3-4-9-27-23/h3-7,9,11-13,15,18,32H,8,10,14,16H2,1-2H3/t18-/m1/s1
InChIKeyRYEOJSCZUKGMQT-GOSISDBHSA-N
MW479.97 g/mol
LogP4.25
Rot. Bonds7

About 1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol

1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol (PubChem CID 134436432) has the molecular formula C25H26ClN5O3 and a molecular weight of 479.97 g/mol. Its IUPAC name is 1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol
PubChem CID134436432
Molecular FormulaC25H26ClN5O3
Molecular Weight479.97 g/mol
Exact Mass479.17
IUPAC Name1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol
SMILESCC(C)(O)COc1cc(-c2ccc(N3CC[C@@H](Oc4ccccn4)C3)nc2)c2c(Cl)cnn2c1
InChIInChI=1S/C25H26ClN5O3/c1-25(2,32)16-33-19-11-20(24-21(26)13-29-31(24)15-19)17-6-7-22(28-12-17)30-10-8-18(14-30)34-23-5-3-4-9-27-23/h3-7,9,11-13,15,18,32H,8,10,14,16H2,1-2H3/t18-/m1/s1
InChIKeyRYEOJSCZUKGMQT-GOSISDBHSA-N
XLogP4.25
TPSA85.01 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500479.97
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol?
The IUPAC name of 1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol (CID 134436432) is 1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol.
What is the SMILES notation for 1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol?
The canonical SMILES for 1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol is CC(C)(O)COc1cc(-c2ccc(N3CC[C@@H](Oc4ccccn4)C3)nc2)c2c(Cl)cnn2c1.
What is the InChIKey of 1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol?
The InChIKey is RYEOJSCZUKGMQT-GOSISDBHSA-N. The full InChI is InChI=1S/C25H26ClN5O3/c1-25(2,32)16-33-19-11-20(24-21(26)13-29-31(24)15-19)17-6-7-22(28-12-17)30-10-8-18(14-30)34-23-5-3-4-9-27-23/h3-7,9,11-13,15,18,32H,8,10,14,16H2,1-2H3/t18-/m1/s1.
What are the key properties of 1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol?
1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol has a molecular weight of 479.97 g/mol, XLogP of 4.25, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-chloro-4-[6-[(3R)-3-pyridin-2-yloxypyrrolidin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridin-6-yl]oxy-2-methylpropan-2-ol is sourced from PubChem (CID 134436432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).