3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide

C15H20F2N2O2 — CID 63185292

IUPAC3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide
SMILESCNc1c(F)cc(C(=O)N(C)CC2CCCCO2)cc1F
InChIInChI=1S/C15H20F2N2O2/c1-18-14-12(16)7-10(8-13(14)17)15(20)19(2)9-11-5-3-4-6-21-11/h7-8,11,18H,3-6,9H2,1-2H3
InChIKeySPXFHOMJFXRZHD-UHFFFAOYSA-N
MW298.33 g/mol
LogP2.65
Rot. Bonds4

About 3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide

3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide (PubChem CID 63185292) has the molecular formula C15H20F2N2O2 and a molecular weight of 298.33 g/mol. Its IUPAC name is 3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide
PubChem CID63185292
Molecular FormulaC15H20F2N2O2
Molecular Weight298.33 g/mol
Exact Mass298.15
IUPAC Name3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide
SMILESCNc1c(F)cc(C(=O)N(C)CC2CCCCO2)cc1F
InChIInChI=1S/C15H20F2N2O2/c1-18-14-12(16)7-10(8-13(14)17)15(20)19(2)9-11-5-3-4-6-21-11/h7-8,11,18H,3-6,9H2,1-2H3
InChIKeySPXFHOMJFXRZHD-UHFFFAOYSA-N
XLogP2.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.33
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3,5-difluoro-4-(methylamino)-N-(oxolan-2-ylmethyl)benzamide
CID 63185072
3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-4-ylmethyl)benzamide
CID 63707118
3,5-difluoro-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide
CID 63185334
3,5-difluoro-4-(methylamino)-N-(oxolan-2-ylmethyl)benzamide
CID 55160007
2-fluoro-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
CID 61435800
2-fluoro-N-methyl-N-(oxan-2-ylmethyl)-5-sulfanylbenzamide
CID 107024526
N-methyl-2-(methylamino)-N-(oxan-2-ylmethyl)benzamide
CID 61436480
4-hydroxy-N-methyl-N-(oxolan-2-ylmethyl)benzamide
CID 61436471
5,6-dichloro-N-methyl-N-(oxan-2-ylmethyl)pyridine-3-carboxamide
CID 61218020
4-(3-cyano-4-fluorophenyl)-N-methyl-N-[[(2R)-oxan-2-yl]methyl]benzamide
CID 126449152
4-amino-N-methyl-N-(oxan-2-ylmethyl)benzamide;hydrochloride
CID 119746333
N-(cyclopentylmethyl)-3,5-difluoro-4-hydrazinyl-N-methylbenzamide
CID 63656584

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide?
The IUPAC name of 3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide (CID 63185292) is 3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide.
What is the SMILES notation for 3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide?
The canonical SMILES for 3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide is CNc1c(F)cc(C(=O)N(C)CC2CCCCO2)cc1F.
What is the InChIKey of 3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide?
The InChIKey is SPXFHOMJFXRZHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O2/c1-18-14-12(16)7-10(8-13(14)17)15(20)19(2)9-11-5-3-4-6-21-11/h7-8,11,18H,3-6,9H2,1-2H3.
What are the key properties of 3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide?
3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide has a molecular weight of 298.33 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)benzamide is sourced from PubChem (CID 63185292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).