8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane

C23H28F2N4O2 — CID 157110920

IUPAC8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane
SMILESC.Cc1nc2c(OCc3c(F)cccc3F)cccn2c1C(=O)N[C@H]1CCCN(C)C1
InChIInChI=1S/C22H24F2N4O2.CH4/c1-14-20(22(29)26-15-6-4-10-27(2)12-15)28-11-5-9-19(21(28)25-14)30-13-16-17(23)7-3-8-18(16)24;/h3,5,7-9,11,15H,4,6,10,12-13H2,1-2H3,(H,26,29);1H4/t15-;/m0./s1
InChIKeyAGVNGGHGQWHMJN-RSAXXLAASA-N
MW430.50 g/mol
LogP3.96
Rot. Bonds5

About 8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane

8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane (PubChem CID 157110920) has the molecular formula C23H28F2N4O2 and a molecular weight of 430.50 g/mol. Its IUPAC name is 8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane.

Molecular Properties

Compound Name8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane
PubChem CID157110920
Molecular FormulaC23H28F2N4O2
Molecular Weight430.50 g/mol
Exact Mass430.22
IUPAC Name8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane
SMILESC.Cc1nc2c(OCc3c(F)cccc3F)cccn2c1C(=O)N[C@H]1CCCN(C)C1
InChIInChI=1S/C22H24F2N4O2.CH4/c1-14-20(22(29)26-15-6-4-10-27(2)12-15)28-11-5-9-19(21(28)25-14)30-13-16-17(23)7-3-8-18(16)24;/h3,5,7-9,11,15H,4,6,10,12-13H2,1-2H3,(H,26,29);1H4/t15-;/m0./s1
InChIKeyAGVNGGHGQWHMJN-RSAXXLAASA-N
XLogP3.96
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.50
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

8-[(2,6-difluorophenyl)methoxy]-N-(3-hydroxybutyl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 90135188
8-ethoxy-2-methyl-N-[(3S)-1-(1-methylpiperidin-4-yl)piperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 90090277
N-cyclohexyl-8-(cyclohexylmethoxy)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 129267906
tert-butyl 3-[[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carbonyl]amino]-9-azabicyclo[3.3.1]nonane-9-carboxylate;2,2,2-trifluoroacetic acid
CID 129068697
8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carbonyl chloride
CID 86717886
8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 118144957
8-ethoxy-2-methyl-N-[(3S)-1-sulfamoylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;hydrochloride
CID 162322941
8-[(2,6-difluorophenyl)methoxy]-N-(4,5-dimethyl-1,3-oxazol-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 118144801
(1S,2R)-1-[[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carbonyl]amino]-4-methyl-2,3-dihydro-1H-indene-2-carboxylic acid
CID 71478606
8-[(2,6-difluorophenyl)methoxy]-N-[(2R)-6-hydroxyhexan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 86724642
8-[(2,6-difluorophenyl)methoxy]-N-(3-hydroxy-2-methylbutan-2-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 129268093
(4S,5R)-4-[[8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carbonyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-5-carboxylic acid
CID 90090958

Frequently Asked Questions

What is the IUPAC name of 8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane?
The IUPAC name of 8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane (CID 157110920) is 8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane.
What is the SMILES notation for 8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane?
The canonical SMILES for 8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane is C.Cc1nc2c(OCc3c(F)cccc3F)cccn2c1C(=O)N[C@H]1CCCN(C)C1.
What is the InChIKey of 8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane?
The InChIKey is AGVNGGHGQWHMJN-RSAXXLAASA-N. The full InChI is InChI=1S/C22H24F2N4O2.CH4/c1-14-20(22(29)26-15-6-4-10-27(2)12-15)28-11-5-9-19(21(28)25-14)30-13-16-17(23)7-3-8-18(16)24;/h3,5,7-9,11,15H,4,6,10,12-13H2,1-2H3,(H,26,29);1H4/t15-;/m0./s1.
What are the key properties of 8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane?
8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane has a molecular weight of 430.50 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(2,6-difluorophenyl)methoxy]-2-methyl-N-[(3S)-1-methylpiperidin-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;methane is sourced from PubChem (CID 157110920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).