5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide

C27H28FN5O — CID 90096317

IUPAC5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1cc(-c2ncccc2-c2ccn3ncc(C(=O)NCC4CCN(C)CC4)c3c2)ccc1F
InChIInChI=1S/C27H28FN5O/c1-18-14-21(5-6-24(18)28)26-22(4-3-10-29-26)20-9-13-33-25(15-20)23(17-31-33)27(34)30-16-19-7-11-32(2)12-8-19/h3-6,9-10,13-15,17,19H,7-8,11-12,16H2,1-2H3,(H,30,34)
InChIKeySZHKLRYDQQXCKI-UHFFFAOYSA-N
MW457.55 g/mol
LogP4.58
Rot. Bonds5

About 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide

5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 90096317) has the molecular formula C27H28FN5O and a molecular weight of 457.55 g/mol. Its IUPAC name is 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID90096317
Molecular FormulaC27H28FN5O
Molecular Weight457.55 g/mol
Exact Mass457.23
IUPAC Name5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1cc(-c2ncccc2-c2ccn3ncc(C(=O)NCC4CCN(C)CC4)c3c2)ccc1F
InChIInChI=1S/C27H28FN5O/c1-18-14-21(5-6-24(18)28)26-22(4-3-10-29-26)20-9-13-33-25(15-20)23(17-31-33)27(34)30-16-19-7-11-32(2)12-8-19/h3-6,9-10,13-15,17,19H,7-8,11-12,16H2,1-2H3,(H,30,34)
InChIKeySZHKLRYDQQXCKI-UHFFFAOYSA-N
XLogP4.58
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500457.55
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]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

CID 24958200
CID 24958200
CID 24958198
CID 24958198
CID 147817927
CID 147817927
CID 9820664
CID 9820664
CID 25093327
CID 25093327
CID 49837887
CID 49837887
CID 57382333
CID 57382333
CID 118888923
CID 118888923
CID 89458694
CID 89458694
CID 118381061
CID 118381061
CID 5280160
CID 5280160
CID 21252903
CID 21252903

Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 90096317) is 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide is Cc1cc(-c2ncccc2-c2ccn3ncc(C(=O)NCC4CCN(C)CC4)c3c2)ccc1F.
What is the InChIKey of 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is SZHKLRYDQQXCKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28FN5O/c1-18-14-21(5-6-24(18)28)26-22(4-3-10-29-26)20-9-13-33-25(15-20)23(17-31-33)27(34)30-16-19-7-11-32(2)12-8-19/h3-6,9-10,13-15,17,19H,7-8,11-12,16H2,1-2H3,(H,30,34).
What are the key properties of 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 457.55 g/mol, XLogP of 4.58, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-[(1-methylpiperidin-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 90096317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).