N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide

C16H21N3O2 — CID 166239856

IUPACN-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide
SMILESCCN(CC1CCCO1)C(=O)Cc1cnn2ccccc12
InChIInChI=1S/C16H21N3O2/c1-2-18(12-14-6-5-9-21-14)16(20)10-13-11-17-19-8-4-3-7-15(13)19/h3-4,7-8,11,14H,2,5-6,9-10,12H2,1H3
InChIKeyRKTBBZYUJXKOQQ-UHFFFAOYSA-N
MW287.36 g/mol
LogP1.90
Rot. Bonds5

About N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide

N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide (PubChem CID 166239856) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide
PubChem CID166239856
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC NameN-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide
SMILESCCN(CC1CCCO1)C(=O)Cc1cnn2ccccc12
InChIInChI=1S/C16H21N3O2/c1-2-18(12-14-6-5-9-21-14)16(20)10-13-11-17-19-8-4-3-7-15(13)19/h3-4,7-8,11,14H,2,5-6,9-10,12H2,1H3
InChIKeyRKTBBZYUJXKOQQ-UHFFFAOYSA-N
XLogP1.90
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide?
The IUPAC name of N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide (CID 166239856) is N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide.
What is the SMILES notation for N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide?
The canonical SMILES for N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide is CCN(CC1CCCO1)C(=O)Cc1cnn2ccccc12.
What is the InChIKey of N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide?
The InChIKey is RKTBBZYUJXKOQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-2-18(12-14-6-5-9-21-14)16(20)10-13-11-17-19-8-4-3-7-15(13)19/h3-4,7-8,11,14H,2,5-6,9-10,12H2,1H3.
What are the key properties of N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide?
N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide has a molecular weight of 287.36 g/mol, XLogP of 1.90, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(oxolan-2-ylmethyl)-2-pyrazolo[1,5-a]pyridin-3-ylacetamide is sourced from PubChem (CID 166239856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).