1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine

C20H23N3 — CID 166364029

IUPAC1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine
SMILESCC(NCc1ccn2nccc2c1)C1(c2ccccc2)CCC1
InChIInChI=1S/C20H23N3/c1-16(20(10-5-11-20)18-6-3-2-4-7-18)21-15-17-9-13-23-19(14-17)8-12-22-23/h2-4,6-9,12-14,16,21H,5,10-11,15H2,1H3
InChIKeyYHEXNRJLPFPHQW-UHFFFAOYSA-N
MW305.43 g/mol
LogP3.93
Rot. Bonds5

About 1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine

1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine (PubChem CID 166364029) has the molecular formula C20H23N3 and a molecular weight of 305.43 g/mol. Its IUPAC name is 1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine.

Molecular Properties

Compound Name1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine
PubChem CID166364029
Molecular FormulaC20H23N3
Molecular Weight305.43 g/mol
Exact Mass305.19
IUPAC Name1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine
SMILESCC(NCc1ccn2nccc2c1)C1(c2ccccc2)CCC1
InChIInChI=1S/C20H23N3/c1-16(20(10-5-11-20)18-6-3-2-4-7-18)21-15-17-9-13-23-19(14-17)8-12-22-23/h2-4,6-9,12-14,16,21H,5,10-11,15H2,1H3
InChIKeyYHEXNRJLPFPHQW-UHFFFAOYSA-N
XLogP3.93
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine?
The IUPAC name of 1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine (CID 166364029) is 1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine.
What is the SMILES notation for 1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine?
The canonical SMILES for 1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine is CC(NCc1ccn2nccc2c1)C1(c2ccccc2)CCC1.
What is the InChIKey of 1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine?
The InChIKey is YHEXNRJLPFPHQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3/c1-16(20(10-5-11-20)18-6-3-2-4-7-18)21-15-17-9-13-23-19(14-17)8-12-22-23/h2-4,6-9,12-14,16,21H,5,10-11,15H2,1H3.
What are the key properties of 1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine?
1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine has a molecular weight of 305.43 g/mol, XLogP of 3.93, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-phenylcyclobutyl)-N-(pyrazolo[1,5-a]pyridin-5-ylmethyl)ethanamine is sourced from PubChem (CID 166364029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).