N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide

C19H17N5O2 — CID 52935930

IUPACN-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESCOc1cccc(CNC(=O)c2cn3ccc(-c4cn[nH]c4)cc3n2)c1
InChIInChI=1S/C19H17N5O2/c1-26-16-4-2-3-13(7-16)9-20-19(25)17-12-24-6-5-14(8-18(24)23-17)15-10-21-22-11-15/h2-8,10-12H,9H2,1H3,(H,20,25)(H,21,22)
InChIKeyAIFSPJOEVWWERK-UHFFFAOYSA-N
MW347.38 g/mol
LogP2.66
Rot. Bonds5

About N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide

N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 52935930) has the molecular formula C19H17N5O2 and a molecular weight of 347.38 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID52935930
Molecular FormulaC19H17N5O2
Molecular Weight347.38 g/mol
Exact Mass347.14
IUPAC NameN-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESCOc1cccc(CNC(=O)c2cn3ccc(-c4cn[nH]c4)cc3n2)c1
InChIInChI=1S/C19H17N5O2/c1-26-16-4-2-3-13(7-16)9-20-19(25)17-12-24-6-5-14(8-18(24)23-17)15-10-21-22-11-15/h2-8,10-12H,9H2,1H3,(H,20,25)(H,21,22)
InChIKeyAIFSPJOEVWWERK-UHFFFAOYSA-N
XLogP2.66
TPSA84.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide (CID 52935930) is N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide is COc1cccc(CNC(=O)c2cn3ccc(-c4cn[nH]c4)cc3n2)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is AIFSPJOEVWWERK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2/c1-26-16-4-2-3-13(7-16)9-20-19(25)17-12-24-6-5-14(8-18(24)23-17)15-10-21-22-11-15/h2-8,10-12H,9H2,1H3,(H,20,25)(H,21,22).
What are the key properties of N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide?
N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 347.38 g/mol, XLogP of 2.66, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-7-(1H-pyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 52935930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).