N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide

C19H17F2N3O2 — CID 56708147

IUPACN-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide
SMILESCN(Cc1cccc(C(=O)Nc2ccc(F)cc2F)c1)Cc1ccno1
InChIInChI=1S/C19H17F2N3O2/c1-24(12-16-7-8-22-26-16)11-13-3-2-4-14(9-13)19(25)23-18-6-5-15(20)10-17(18)21/h2-10H,11-12H2,1H3,(H,23,25)
InChIKeyYPAJWSALHLYVQQ-UHFFFAOYSA-N
MW357.36 g/mol
LogP3.84
Rot. Bonds6

About N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide

N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide (PubChem CID 56708147) has the molecular formula C19H17F2N3O2 and a molecular weight of 357.36 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide
PubChem CID56708147
Molecular FormulaC19H17F2N3O2
Molecular Weight357.36 g/mol
Exact Mass357.13
IUPAC NameN-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide
SMILESCN(Cc1cccc(C(=O)Nc2ccc(F)cc2F)c1)Cc1ccno1
InChIInChI=1S/C19H17F2N3O2/c1-24(12-16-7-8-22-26-16)11-13-3-2-4-14(9-13)19(25)23-18-6-5-15(20)10-17(18)21/h2-10H,11-12H2,1H3,(H,23,25)
InChIKeyYPAJWSALHLYVQQ-UHFFFAOYSA-N
XLogP3.84
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.36
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide?
The IUPAC name of N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide (CID 56708147) is N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide?
The canonical SMILES for N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide is CN(Cc1cccc(C(=O)Nc2ccc(F)cc2F)c1)Cc1ccno1.
What is the InChIKey of N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide?
The InChIKey is YPAJWSALHLYVQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F2N3O2/c1-24(12-16-7-8-22-26-16)11-13-3-2-4-14(9-13)19(25)23-18-6-5-15(20)10-17(18)21/h2-10H,11-12H2,1H3,(H,23,25).
What are the key properties of N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide?
N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide has a molecular weight of 357.36 g/mol, XLogP of 3.84, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-3-[[methyl(1,2-oxazol-5-ylmethyl)amino]methyl]benzamide is sourced from PubChem (CID 56708147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).