N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide

C22H18FN5O — CID 178053561

IUPACN-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESC[C@H](NC(=O)c1cnn2ccc(C#Cc3cnn(C)c3)cc12)c1cccc(F)c1
InChIInChI=1S/C22H18FN5O/c1-15(18-4-3-5-19(23)11-18)26-22(29)20-13-25-28-9-8-16(10-21(20)28)6-7-17-12-24-27(2)14-17/h3-5,8-15H,1-2H3,(H,26,29)/t15-/m0/s1
InChIKeyKNHAATGWSCBFBD-HNNXBMFYSA-N
MW387.42 g/mol
LogP3.10
Rot. Bonds3

About N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide

N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 178053561) has the molecular formula C22H18FN5O and a molecular weight of 387.42 g/mol. Its IUPAC name is N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID178053561
Molecular FormulaC22H18FN5O
Molecular Weight387.42 g/mol
Exact Mass387.15
IUPAC NameN-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESC[C@H](NC(=O)c1cnn2ccc(C#Cc3cnn(C)c3)cc12)c1cccc(F)c1
InChIInChI=1S/C22H18FN5O/c1-15(18-4-3-5-19(23)11-18)26-22(29)20-13-25-28-9-8-16(10-21(20)28)6-7-17-12-24-27(2)14-17/h3-5,8-15H,1-2H3,(H,26,29)/t15-/m0/s1
InChIKeyKNHAATGWSCBFBD-HNNXBMFYSA-N
XLogP3.10
TPSA64.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.42
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1S)-1-(3-fluorophenyl)ethyl]-2,6-bis(1-methylpyrazol-4-yl)pyrimidine-4-carboxamide
CID 165389673
4-fluoro-2-hydroxy-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]benzamide
CID 99717451
N-[1-(3-fluorophenyl)ethyl]-2-sulfanylbenzamide
CID 103601942
4-amino-N-[1-(3-fluorophenyl)ethyl]-1,3-dimethylpyrazole-5-carboxamide
CID 66123418
4-bromo-N-[1-(3-fluorophenyl)ethyl]-2-methoxybenzamide
CID 78987865
2-bromo-4-fluoro-N-[1-(3-fluorophenyl)ethyl]benzamide
CID 51206122
N-[1-(3-fluorophenyl)ethyl]-5-[2-(3-hydroxyazetidin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]-1-methylindole-3-carboxamide
CID 170010037
N-[1-(1-benzylpyrazol-4-yl)ethyl]-5-methoxypyrazolo[1,5-a]pyridine-3-carboxamide
CID 166192226
5-chloro-2-methoxy-N-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]benzamide
CID 35276397
N-[1-(3-fluorophenyl)ethyl]-4-sulfanylbenzamide
CID 107025556
N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide
CID 81366934
N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide
CID 60630491

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 178053561) is N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide is C[C@H](NC(=O)c1cnn2ccc(C#Cc3cnn(C)c3)cc12)c1cccc(F)c1.
What is the InChIKey of N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is KNHAATGWSCBFBD-HNNXBMFYSA-N. The full InChI is InChI=1S/C22H18FN5O/c1-15(18-4-3-5-19(23)11-18)26-22(29)20-13-25-28-9-8-16(10-21(20)28)6-7-17-12-24-27(2)14-17/h3-5,8-15H,1-2H3,(H,26,29)/t15-/m0/s1.
What are the key properties of N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 387.42 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(3-fluorophenyl)ethyl]-5-[2-(1-methylpyrazol-4-yl)ethynyl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 178053561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).