N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide

C25H22F2N4O3 — CID 55518292

IUPACN-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
SMILESCNC(=O)C(NC(=O)c1ccc(OCc2cn3cc(C)ccc3n2)cc1)c1ccc(F)c(F)c1
InChIInChI=1S/C25H22F2N4O3/c1-15-3-10-22-29-18(13-31(22)12-15)14-34-19-7-4-16(5-8-19)24(32)30-23(25(33)28-2)17-6-9-20(26)21(27)11-17/h3-13,23H,14H2,1-2H3,(H,28,33)(H,30,32)
InChIKeyLPLOMPMFTTZBHH-UHFFFAOYSA-N
MW464.47 g/mol
LogP3.72
Rot. Bonds7

About N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide

N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide (PubChem CID 55518292) has the molecular formula C25H22F2N4O3 and a molecular weight of 464.47 g/mol. Its IUPAC name is N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide.

Molecular Properties

Compound NameN-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
PubChem CID55518292
Molecular FormulaC25H22F2N4O3
Molecular Weight464.47 g/mol
Exact Mass464.17
IUPAC NameN-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
SMILESCNC(=O)C(NC(=O)c1ccc(OCc2cn3cc(C)ccc3n2)cc1)c1ccc(F)c(F)c1
InChIInChI=1S/C25H22F2N4O3/c1-15-3-10-22-29-18(13-31(22)12-15)14-34-19-7-4-16(5-8-19)24(32)30-23(25(33)28-2)17-6-9-20(26)21(27)11-17/h3-13,23H,14H2,1-2H3,(H,28,33)(H,30,32)
InChIKeyLPLOMPMFTTZBHH-UHFFFAOYSA-N
XLogP3.72
TPSA84.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.47
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N'-(4-chlorobenzoyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzohydrazide
CID 42093678
N-[1-(2,4-difluorophenyl)ethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 24616282
N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-(2,2,2-trifluoroethoxy)benzamide
CID 55629313
1-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]ethanone
CID 82530473
1-[4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]phenyl]propan-1-one
CID 112787371
N-[(1R)-1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]benzamide
CID 95402613
N-(2-fluoro-5-methylphenyl)-4-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 40722968
4-butoxy-N-[2-[[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]benzamide
CID 55483855
N-(2,5-diethoxyphenyl)-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
CID 24617344
N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-3-phenylmethoxybenzamide
CID 55501489
tert-butyl N-[4-[[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]carbamoyl]phenyl]carbamate
CID 55501862
4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]-N-(6-pyrrolidin-1-yl-3-pyridinyl)benzamide
CID 25432356

Frequently Asked Questions

What is the IUPAC name of N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
The IUPAC name of N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide (CID 55518292) is N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide.
What is the SMILES notation for N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
The canonical SMILES for N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide is CNC(=O)C(NC(=O)c1ccc(OCc2cn3cc(C)ccc3n2)cc1)c1ccc(F)c(F)c1.
What is the InChIKey of N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
The InChIKey is LPLOMPMFTTZBHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22F2N4O3/c1-15-3-10-22-29-18(13-31(22)12-15)14-34-19-7-4-16(5-8-19)24(32)30-23(25(33)28-2)17-6-9-20(26)21(27)11-17/h3-13,23H,14H2,1-2H3,(H,28,33)(H,30,32).
What are the key properties of N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?
N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide has a molecular weight of 464.47 g/mol, XLogP of 3.72, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3,4-difluorophenyl)-2-(methylamino)-2-oxoethyl]-4-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide is sourced from PubChem (CID 55518292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).