8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

C26H26FN3O3 — CID 144635819

IUPAC8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2c(OCc3ccccc3F)cccn2c1C(=O)NC(C)(C)c1ccc(CO)cc1
InChIInChI=1S/C26H26FN3O3/c1-17-23(25(32)29-26(2,3)20-12-10-18(15-31)11-13-20)30-14-6-9-22(24(30)28-17)33-16-19-7-4-5-8-21(19)27/h4-14,31H,15-16H2,1-3H3,(H,29,32)
InChIKeyDSELCYGJUAELAP-UHFFFAOYSA-N
MW447.51 g/mol
LogP4.52
Rot. Bonds7

About 8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 144635819) has the molecular formula C26H26FN3O3 and a molecular weight of 447.51 g/mol. Its IUPAC name is 8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID144635819
Molecular FormulaC26H26FN3O3
Molecular Weight447.51 g/mol
Exact Mass447.20
IUPAC Name8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2c(OCc3ccccc3F)cccn2c1C(=O)NC(C)(C)c1ccc(CO)cc1
InChIInChI=1S/C26H26FN3O3/c1-17-23(25(32)29-26(2,3)20-12-10-18(15-31)11-13-20)30-14-6-9-22(24(30)28-17)33-16-19-7-4-5-8-21(19)27/h4-14,31H,15-16H2,1-3H3,(H,29,32)
InChIKeyDSELCYGJUAELAP-UHFFFAOYSA-N
XLogP4.52
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.51
LogP ≤ 54.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

8-[(2,6-difluorophenyl)methoxy]-N-[1,3-dihydroxy-2-(4-methylphenyl)propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 90090956
1-[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]-4-hydroxy-3-[4-(hydroxymethyl)phenyl]-3-methylbutan-1-one
CID 157199247
N-[(1R,2S,3S)-2,3-dihydroxy-2,3-dihydro-1H-inden-1-yl]-8-[(2-fluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 71478863
8-[(2,6-difluorophenyl)methoxy]-N-(3-hydroxy-2-methylbutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 129268093
8-[(2,6-difluorophenyl)methoxy]-N-[1-hydroxy-2-(4-methyl-1,3-thiazol-2-yl)propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 118321176
8-[(2,6-difluorophenyl)methoxy]-N-[1,3-dihydroxy-2-(1-methylpyrazol-4-yl)propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 118321213
8-[(2,6-difluorophenyl)methoxy]-N-[1-hydroxy-2-(5-methyl-1,3,4-thiadiazol-2-yl)propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 118321207
N-(2,2-dimethyl-5-phenyl-1,3-dioxan-5-yl)-8-[(2-fluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 90091097
methyl 3-[(2R)-2-[[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carbonyl]amino]-1-hydroxypropan-2-yl]benzoate
CID 118321164
8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-(7,7,7-trifluoro-2-hydroxy-2-methylheptan-3-yl)imidazo[1,2-a]pyridine-3-carboxamide
CID 90115694
8-[(2,3-difluorophenyl)methoxy]-N-[(2S,3S)-2,3-dihydroxy-2,3-dihydro-1H-inden-1-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 71479016
8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carbonyl chloride
CID 86717886

Frequently Asked Questions

What is the IUPAC name of 8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 144635819) is 8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is Cc1nc2c(OCc3ccccc3F)cccn2c1C(=O)NC(C)(C)c1ccc(CO)cc1.
What is the InChIKey of 8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is DSELCYGJUAELAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26FN3O3/c1-17-23(25(32)29-26(2,3)20-12-10-18(15-31)11-13-20)30-14-6-9-22(24(30)28-17)33-16-19-7-4-5-8-21(19)27/h4-14,31H,15-16H2,1-3H3,(H,29,32).
What are the key properties of 8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 447.51 g/mol, XLogP of 4.52, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(2-fluorophenyl)methoxy]-N-[2-[4-(hydroxymethyl)phenyl]propan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 144635819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).