3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide

C27H25N5O2 — CID 30761257

IUPAC3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide
SMILESCc1ccc2nc(COc3cccc(C(=O)NCCc4ccc(-n5cccn5)cc4)c3)cn2c1
InChIInChI=1S/C27H25N5O2/c1-20-6-11-26-30-23(18-31(26)17-20)19-34-25-5-2-4-22(16-25)27(33)28-14-12-21-7-9-24(10-8-21)32-15-3-13-29-32/h2-11,13,15-18H,12,14,19H2,1H3,(H,28,33)
InChIKeyHSZDQJCPJODBHX-UHFFFAOYSA-N
MW451.53 g/mol
LogP4.38
Rot. Bonds8

About 3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide

3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide (PubChem CID 30761257) has the molecular formula C27H25N5O2 and a molecular weight of 451.53 g/mol. Its IUPAC name is 3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide.

Molecular Properties

Compound Name3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide
PubChem CID30761257
Molecular FormulaC27H25N5O2
Molecular Weight451.53 g/mol
Exact Mass451.20
IUPAC Name3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide
SMILESCc1ccc2nc(COc3cccc(C(=O)NCCc4ccc(-n5cccn5)cc4)c3)cn2c1
InChIInChI=1S/C27H25N5O2/c1-20-6-11-26-30-23(18-31(26)17-20)19-34-25-5-2-4-22(16-25)27(33)28-14-12-21-7-9-24(10-8-21)32-15-3-13-29-32/h2-11,13,15-18H,12,14,19H2,1H3,(H,28,33)
InChIKeyHSZDQJCPJODBHX-UHFFFAOYSA-N
XLogP4.38
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms34
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.53
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide?
The IUPAC name of 3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide (CID 30761257) is 3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide.
What is the SMILES notation for 3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide?
The canonical SMILES for 3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide is Cc1ccc2nc(COc3cccc(C(=O)NCCc4ccc(-n5cccn5)cc4)c3)cn2c1.
What is the InChIKey of 3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide?
The InChIKey is HSZDQJCPJODBHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H25N5O2/c1-20-6-11-26-30-23(18-31(26)17-20)19-34-25-5-2-4-22(16-25)27(33)28-14-12-21-7-9-24(10-8-21)32-15-3-13-29-32/h2-11,13,15-18H,12,14,19H2,1H3,(H,28,33).
What are the key properties of 3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide?
3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide has a molecular weight of 451.53 g/mol, XLogP of 4.38, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide is sourced from PubChem (CID 30761257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).