N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide

C17H17N3O — CID 56882587

IUPACN-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide
SMILESCCC(=O)NCc1cccc(-c2cccc3ccnn23)c1
InChIInChI=1S/C17H17N3O/c1-2-17(21)18-12-13-5-3-6-14(11-13)16-8-4-7-15-9-10-19-20(15)16/h3-11H,2,12H2,1H3,(H,18,21)
InChIKeyXKKNXWWILVOYDS-UHFFFAOYSA-N
MW279.34 g/mol
LogP3.03
Rot. Bonds4

About N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide

N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide (PubChem CID 56882587) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide.

Molecular Properties

Compound NameN-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide
PubChem CID56882587
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC NameN-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide
SMILESCCC(=O)NCc1cccc(-c2cccc3ccnn23)c1
InChIInChI=1S/C17H17N3O/c1-2-17(21)18-12-13-5-3-6-14(11-13)16-8-4-7-15-9-10-19-20(15)16/h3-11H,2,12H2,1H3,(H,18,21)
InChIKeyXKKNXWWILVOYDS-UHFFFAOYSA-N
XLogP3.03
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide?
The IUPAC name of N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide (CID 56882587) is N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide.
What is the SMILES notation for N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide?
The canonical SMILES for N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide is CCC(=O)NCc1cccc(-c2cccc3ccnn23)c1.
What is the InChIKey of N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide?
The InChIKey is XKKNXWWILVOYDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-2-17(21)18-12-13-5-3-6-14(11-13)16-8-4-7-15-9-10-19-20(15)16/h3-11H,2,12H2,1H3,(H,18,21).
What are the key properties of N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide?
N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide has a molecular weight of 279.34 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-pyrazolo[1,5-a]pyridin-7-ylphenyl)methyl]propanamide is sourced from PubChem (CID 56882587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).