N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide

C25H21N5O2 — CID 56582430

IUPACN-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide
SMILESO=C(Cc1cnn(-c2ccccc2)c1)Nc1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C25H21N5O2/c31-25(13-19-15-26-30(16-19)22-8-2-1-3-9-22)28-20-7-6-10-23(14-20)32-18-21-17-29-12-5-4-11-24(29)27-21/h1-12,14-17H,13,18H2,(H,28,31)
InChIKeyGZDFHZWHRALEHP-UHFFFAOYSA-N
MW423.48 g/mol
LogP4.28
Rot. Bonds7

About N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide

N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide (PubChem CID 56582430) has the molecular formula C25H21N5O2 and a molecular weight of 423.48 g/mol. Its IUPAC name is N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide
PubChem CID56582430
Molecular FormulaC25H21N5O2
Molecular Weight423.48 g/mol
Exact Mass423.17
IUPAC NameN-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide
SMILESO=C(Cc1cnn(-c2ccccc2)c1)Nc1cccc(OCc2cn3ccccc3n2)c1
InChIInChI=1S/C25H21N5O2/c31-25(13-19-15-26-30(16-19)22-8-2-1-3-9-22)28-20-7-6-10-23(14-20)32-18-21-17-29-12-5-4-11-24(29)27-21/h1-12,14-17H,13,18H2,(H,28,31)
InChIKeyGZDFHZWHRALEHP-UHFFFAOYSA-N
XLogP4.28
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.48
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide?
The IUPAC name of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide (CID 56582430) is N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide.
What is the SMILES notation for N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide?
The canonical SMILES for N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide is O=C(Cc1cnn(-c2ccccc2)c1)Nc1cccc(OCc2cn3ccccc3n2)c1.
What is the InChIKey of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide?
The InChIKey is GZDFHZWHRALEHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N5O2/c31-25(13-19-15-26-30(16-19)22-8-2-1-3-9-22)28-20-7-6-10-23(14-20)32-18-21-17-29-12-5-4-11-24(29)27-21/h1-12,14-17H,13,18H2,(H,28,31).
What are the key properties of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide?
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide has a molecular weight of 423.48 g/mol, XLogP of 4.28, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(1-phenylpyrazol-4-yl)acetamide is sourced from PubChem (CID 56582430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).