(5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone

C17H22N4O2 — CID 138010804

IUPAC(5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone
SMILESCC1(C)CN(C(=O)c2cnn3ccc(N)cc23)C1C1CCCO1
InChIInChI=1S/C17H22N4O2/c1-17(2)10-20(15(17)14-4-3-7-23-14)16(22)12-9-19-21-6-5-11(18)8-13(12)21/h5-6,8-9,14-15H,3-4,7,10,18H2,1-2H3
InChIKeyRYNXHADBBSFXEU-UHFFFAOYSA-N
MW314.39 g/mol
LogP1.95
Rot. Bonds2

About (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone

(5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone (PubChem CID 138010804) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone.

Molecular Properties

Compound Name(5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone
PubChem CID138010804
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC Name(5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone
SMILESCC1(C)CN(C(=O)c2cnn3ccc(N)cc23)C1C1CCCO1
InChIInChI=1S/C17H22N4O2/c1-17(2)10-20(15(17)14-4-3-7-23-14)16(22)12-9-19-21-6-5-11(18)8-13(12)21/h5-6,8-9,14-15H,3-4,7,10,18H2,1-2H3
InChIKeyRYNXHADBBSFXEU-UHFFFAOYSA-N
XLogP1.95
TPSA72.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone?
The IUPAC name of (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone (CID 138010804) is (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone.
What is the SMILES notation for (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone?
The canonical SMILES for (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone is CC1(C)CN(C(=O)c2cnn3ccc(N)cc23)C1C1CCCO1.
What is the InChIKey of (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone?
The InChIKey is RYNXHADBBSFXEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O2/c1-17(2)10-20(15(17)14-4-3-7-23-14)16(22)12-9-19-21-6-5-11(18)8-13(12)21/h5-6,8-9,14-15H,3-4,7,10,18H2,1-2H3.
What are the key properties of (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone?
(5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone has a molecular weight of 314.39 g/mol, XLogP of 1.95, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-aminopyrazolo[1,5-a]pyridin-3-yl)-[3,3-dimethyl-2-(oxolan-2-yl)azetidin-1-yl]methanone is sourced from PubChem (CID 138010804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).