N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide

C26H26FN3O3 — CID 146264140

IUPACN-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCOC[C@@H](C)N(Cc1cccc(OCc2ccccc2F)c1)C(=O)c1cn2ccccc2n1
InChIInChI=1S/C26H26FN3O3/c1-19(17-32-2)30(26(31)24-16-29-13-6-5-12-25(29)28-24)15-20-8-7-10-22(14-20)33-18-21-9-3-4-11-23(21)27/h3-14,16,19H,15,17-18H2,1-2H3/t19-/m1/s1
InChIKeyMASXRLLDIJISSN-LJQANCHMSA-N
MW447.51 g/mol
LogP4.73
Rot. Bonds9

About N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide

N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 146264140) has the molecular formula C26H26FN3O3 and a molecular weight of 447.51 g/mol. Its IUPAC name is N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID146264140
Molecular FormulaC26H26FN3O3
Molecular Weight447.51 g/mol
Exact Mass447.20
IUPAC NameN-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCOC[C@@H](C)N(Cc1cccc(OCc2ccccc2F)c1)C(=O)c1cn2ccccc2n1
InChIInChI=1S/C26H26FN3O3/c1-19(17-32-2)30(26(31)24-16-29-13-6-5-12-25(29)28-24)15-20-8-7-10-22(14-20)33-18-21-9-3-4-11-23(21)27/h3-14,16,19H,15,17-18H2,1-2H3/t19-/m1/s1
InChIKeyMASXRLLDIJISSN-LJQANCHMSA-N
XLogP4.73
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.51
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 146264047
(2S)-N-[[4-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-(1-imidazo[1,2-a]pyridin-2-ylethenyl)-1-methoxypropan-2-amine
CID 159638766
6-chloro-N-[(3-fluorophenyl)methyl]-N-[(2S)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide
CID 92627163
N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]imidazo[1,2-a]pyrimidine-2-carboxamide
CID 146264054
N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]imidazo[1,2-a]pyrazine-2-carboxamide;N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide;N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]imidazo[1,2-a]pyrimidine-2-carboxamide;N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 167574213
N-[2-[3-[(2-fluorophenyl)methoxy]phenyl]ethyl]propan-2-amine
CID 154512400
3-[(2-fluorophenyl)methyl-[(2S)-1-methoxypropan-2-yl]carbamoyl]benzoic acid
CID 126435798
N-(2-methoxyethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 51253266
(2S)-2-[[3-[(2-fluorophenyl)methoxy]phenyl]methylamino]-3-methylbutanoic acid
CID 99124267
3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-[(2S)-4-methoxybutan-2-yl]benzamide
CID 52843285
N-(2-methoxy-1-pyridin-2-ylethyl)-N-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 74239636
N-[(3,5-dimethoxyphenyl)methyl]-3-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 55576832

Frequently Asked Questions

What is the IUPAC name of N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide (CID 146264140) is N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide is COC[C@@H](C)N(Cc1cccc(OCc2ccccc2F)c1)C(=O)c1cn2ccccc2n1.
What is the InChIKey of N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is MASXRLLDIJISSN-LJQANCHMSA-N. The full InChI is InChI=1S/C26H26FN3O3/c1-19(17-32-2)30(26(31)24-16-29-13-6-5-12-25(29)28-24)15-20-8-7-10-22(14-20)33-18-21-9-3-4-11-23(21)27/h3-14,16,19H,15,17-18H2,1-2H3/t19-/m1/s1.
What are the key properties of N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide?
N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 447.51 g/mol, XLogP of 4.73, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(2-fluorophenyl)methoxy]phenyl]methyl]-N-[(2R)-1-methoxypropan-2-yl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 146264140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).