N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide

C24H24N6O3 — CID 90157612

IUPACN-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide
SMILESCNC(=O)c1ccc(-c2cnn3ccc(C(=O)N(C)c4ccc(OCCN)cn4)cc23)cc1
InChIInChI=1S/C24H24N6O3/c1-26-23(31)17-5-3-16(4-6-17)20-15-28-30-11-9-18(13-21(20)30)24(32)29(2)22-8-7-19(14-27-22)33-12-10-25/h3-9,11,13-15H,10,12,25H2,1-2H3,(H,26,31)
InChIKeyMNWWEGIFDNKMNJ-UHFFFAOYSA-N
MW444.50 g/mol
LogP2.37
Rot. Bonds7

About N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide

N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide (PubChem CID 90157612) has the molecular formula C24H24N6O3 and a molecular weight of 444.50 g/mol. Its IUPAC name is N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide
PubChem CID90157612
Molecular FormulaC24H24N6O3
Molecular Weight444.50 g/mol
Exact Mass444.19
IUPAC NameN-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide
SMILESCNC(=O)c1ccc(-c2cnn3ccc(C(=O)N(C)c4ccc(OCCN)cn4)cc23)cc1
InChIInChI=1S/C24H24N6O3/c1-26-23(31)17-5-3-16(4-6-17)20-15-28-30-11-9-18(13-21(20)30)24(32)29(2)22-8-7-19(14-27-22)33-12-10-25/h3-9,11,13-15H,10,12,25H2,1-2H3,(H,26,31)
InChIKeyMNWWEGIFDNKMNJ-UHFFFAOYSA-N
XLogP2.37
TPSA114.85 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.50
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide?
The IUPAC name of N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide (CID 90157612) is N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide.
What is the SMILES notation for N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide?
The canonical SMILES for N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide is CNC(=O)c1ccc(-c2cnn3ccc(C(=O)N(C)c4ccc(OCCN)cn4)cc23)cc1.
What is the InChIKey of N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide?
The InChIKey is MNWWEGIFDNKMNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N6O3/c1-26-23(31)17-5-3-16(4-6-17)20-15-28-30-11-9-18(13-21(20)30)24(32)29(2)22-8-7-19(14-27-22)33-12-10-25/h3-9,11,13-15H,10,12,25H2,1-2H3,(H,26,31).
What are the key properties of N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide?
N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide has a molecular weight of 444.50 g/mol, XLogP of 2.37, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-aminoethoxy)-2-pyridinyl]-N-methyl-3-[4-(methylcarbamoyl)phenyl]pyrazolo[1,5-a]pyridine-5-carboxamide is sourced from PubChem (CID 90157612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).