3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide

C22H21FN2O3 — CID 59735848

IUPAC3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide
SMILESCC(C)Oc1cc(OCc2ccccc2F)cc(C(=O)Nc2ccccn2)c1
InChIInChI=1S/C22H21FN2O3/c1-15(2)28-19-12-17(22(26)25-21-9-5-6-10-24-21)11-18(13-19)27-14-16-7-3-4-8-20(16)23/h3-13,15H,14H2,1-2H3,(H,24,25,26)
InChIKeyKXSNWPUEFMECGB-UHFFFAOYSA-N
MW380.42 g/mol
LogP4.84
Rot. Bonds7

About 3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide

3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide (PubChem CID 59735848) has the molecular formula C22H21FN2O3 and a molecular weight of 380.42 g/mol. Its IUPAC name is 3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide.

Molecular Properties

Compound Name3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide
PubChem CID59735848
Molecular FormulaC22H21FN2O3
Molecular Weight380.42 g/mol
Exact Mass380.15
IUPAC Name3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide
SMILESCC(C)Oc1cc(OCc2ccccc2F)cc(C(=O)Nc2ccccn2)c1
InChIInChI=1S/C22H21FN2O3/c1-15(2)28-19-12-17(22(26)25-21-9-5-6-10-24-21)11-18(13-19)27-14-16-7-3-4-8-20(16)23/h3-13,15H,14H2,1-2H3,(H,24,25,26)
InChIKeyKXSNWPUEFMECGB-UHFFFAOYSA-N
XLogP4.84
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.42
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-bis[(2-fluorophenyl)methoxy]-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 59735905
3-[(2-fluorophenyl)methoxy]-N-methylbenzamide
CID 13176420
3-[(6-ethylsulfonyl-3-pyridinyl)oxy]-5-[(2S)-1-hydroxypropan-2-yl]oxy-N-pyridin-2-ylbenzamide
CID 59811559
tert-butyl 3-[(3-phenylmethoxy-5-propan-2-yloxybenzoyl)amino]pyrazole-1-carboxylate
CID 57469201
N-[4-[(2-fluorophenyl)methylamino]phenyl]-3,5-dimethoxybenzamide
CID 112982381
5-[(2-fluorophenyl)methoxy]-2-propan-2-yloxybenzoic acid
CID 141305036
6-[2-(2-fluorophenyl)ethylamino]-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109158531
N-[5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-yl]-4-propan-2-yloxybenzamide
CID 3685021
2-(4-chlorophenoxy)-N-pyridin-2-ylpropanamide
CID 51193962
2-[3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxyphenyl]-3H-imidazo[4,5-c]pyridine
CID 59243052
[4-[3-propan-2-yloxy-5-(pyrazin-2-ylcarbamoyl)phenoxy]phenyl]phosphonic acid
CID 118041305
3,5-bis[(2-chlorophenyl)methoxy]-N-(5-chloropyrazin-2-yl)benzamide
CID 59735837

Frequently Asked Questions

What is the IUPAC name of 3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide?
The IUPAC name of 3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide (CID 59735848) is 3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide.
What is the SMILES notation for 3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide?
The canonical SMILES for 3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide is CC(C)Oc1cc(OCc2ccccc2F)cc(C(=O)Nc2ccccn2)c1.
What is the InChIKey of 3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide?
The InChIKey is KXSNWPUEFMECGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21FN2O3/c1-15(2)28-19-12-17(22(26)25-21-9-5-6-10-24-21)11-18(13-19)27-14-16-7-3-4-8-20(16)23/h3-13,15H,14H2,1-2H3,(H,24,25,26).
What are the key properties of 3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide?
3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide has a molecular weight of 380.42 g/mol, XLogP of 4.84, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-fluorophenyl)methoxy]-5-propan-2-yloxy-N-pyridin-2-ylbenzamide is sourced from PubChem (CID 59735848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).