2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol

C23H23N3O — CID 155510671

IUPAC2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol
SMILESCc1c(-c2ccccc2)cccc1-c1cc2ccc(CNCCO)cn2n1
InChIInChI=1S/C23H23N3O/c1-17-21(19-6-3-2-4-7-19)8-5-9-22(17)23-14-20-11-10-18(15-24-12-13-27)16-26(20)25-23/h2-11,14,16,24,27H,12-13,15H2,1H3
InChIKeyFSIJZAKUZYFSNQ-UHFFFAOYSA-N
MW357.46 g/mol
LogP4.06
Rot. Bonds6

About 2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol

2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol (PubChem CID 155510671) has the molecular formula C23H23N3O and a molecular weight of 357.46 g/mol. Its IUPAC name is 2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol.

Molecular Properties

Compound Name2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol
PubChem CID155510671
Molecular FormulaC23H23N3O
Molecular Weight357.46 g/mol
Exact Mass357.18
IUPAC Name2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol
SMILESCc1c(-c2ccccc2)cccc1-c1cc2ccc(CNCCO)cn2n1
InChIInChI=1S/C23H23N3O/c1-17-21(19-6-3-2-4-7-19)8-5-9-22(17)23-14-20-11-10-18(15-24-12-13-27)16-26(20)25-23/h2-11,14,16,24,27H,12-13,15H2,1H3
InChIKeyFSIJZAKUZYFSNQ-UHFFFAOYSA-N
XLogP4.06
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol?
The IUPAC name of 2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol (CID 155510671) is 2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol.
What is the SMILES notation for 2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol?
The canonical SMILES for 2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol is Cc1c(-c2ccccc2)cccc1-c1cc2ccc(CNCCO)cn2n1.
What is the InChIKey of 2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol?
The InChIKey is FSIJZAKUZYFSNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O/c1-17-21(19-6-3-2-4-7-19)8-5-9-22(17)23-14-20-11-10-18(15-24-12-13-27)16-26(20)25-23/h2-11,14,16,24,27H,12-13,15H2,1H3.
What are the key properties of 2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol?
2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol has a molecular weight of 357.46 g/mol, XLogP of 4.06, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-methyl-3-phenylphenyl)pyrazolo[1,5-a]pyridin-6-yl]methylamino]ethanol is sourced from PubChem (CID 155510671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).