1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one

C16H21N3O2 — CID 163793421

IUPAC1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one
SMILESCCC(=O)c1cnn2ccc(OCCN3CCCC3)cc12
InChIInChI=1S/C16H21N3O2/c1-2-16(20)14-12-17-19-8-5-13(11-15(14)19)21-10-9-18-6-3-4-7-18/h5,8,11-12H,2-4,6-7,9-10H2,1H3
InChIKeyMYTLAGRTGJNZDV-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.40
Rot. Bonds6

About 1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one

1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one (PubChem CID 163793421) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one.

Molecular Properties

Compound Name1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one
PubChem CID163793421
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one
SMILESCCC(=O)c1cnn2ccc(OCCN3CCCC3)cc12
InChIInChI=1S/C16H21N3O2/c1-2-16(20)14-12-17-19-8-5-13(11-15(14)19)21-10-9-18-6-3-4-7-18/h5,8,11-12H,2-4,6-7,9-10H2,1H3
InChIKeyMYTLAGRTGJNZDV-UHFFFAOYSA-N
XLogP2.40
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridine-3-carboxylic acid
CID 90299273
methyl 5-[4-[4-(2-chlorophenyl)piperazin-1-yl]butoxy]pyrazolo[1,5-a]pyridine-3-carboxylate
CID 68716440
5-amino-N-[4-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 155955431
ethoxy-[6-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]methanol
CID 152913174
1-[2-hydroxy-4-(2-piperidin-1-ylethoxy)phenyl]butan-1-one
CID 30266
3-[2-(azocan-1-yl)ethoxy]benzoic acid
CID 43532593
3-chloro-5-[4-[4-(2-chlorophenyl)piperazin-1-yl]butoxy]pyrazolo[1,5-a]pyridine
CID 25072327
1-[2-[3-[2-ethyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]but-1-enyl]phenoxy]ethyl]pyrrolidine
CID 132508115
1-(2-methyl-4-propoxyphenyl)-3-piperidin-1-ylpropan-1-one
CID 566846
5-(2-pyrrolidin-1-ylethoxy)pyridine-2-carboxylic acid
CID 79793888
1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine
CID 803619
2-piperidin-1-ylethyl 4-butoxy-2-(2-piperidin-1-ylethyl)benzoate
CID 90023939

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one?
The IUPAC name of 1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one (CID 163793421) is 1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one.
What is the SMILES notation for 1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one?
The canonical SMILES for 1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one is CCC(=O)c1cnn2ccc(OCCN3CCCC3)cc12.
What is the InChIKey of 1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one?
The InChIKey is MYTLAGRTGJNZDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-2-16(20)14-12-17-19-8-5-13(11-15(14)19)21-10-9-18-6-3-4-7-18/h5,8,11-12H,2-4,6-7,9-10H2,1H3.
What are the key properties of 1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one?
1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one has a molecular weight of 287.36 g/mol, XLogP of 2.40, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2-pyrrolidin-1-ylethoxy)pyrazolo[1,5-a]pyridin-3-yl]propan-1-one is sourced from PubChem (CID 163793421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).