3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide

C15H16F2N2O2 — CID 63185216

IUPAC3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
SMILESCNc1c(F)cc(C(=O)NC(C)c2ccc(C)o2)cc1F
InChIInChI=1S/C15H16F2N2O2/c1-8-4-5-13(21-8)9(2)19-15(20)10-6-11(16)14(18-3)12(17)7-10/h4-7,9,18H,1-3H3,(H,19,20)
InChIKeyDUTIPHSYDYTSIO-UHFFFAOYSA-N
MW294.30 g/mol
LogP3.40
Rot. Bonds4

About 3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide

3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide (PubChem CID 63185216) has the molecular formula C15H16F2N2O2 and a molecular weight of 294.30 g/mol. Its IUPAC name is 3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
PubChem CID63185216
Molecular FormulaC15H16F2N2O2
Molecular Weight294.30 g/mol
Exact Mass294.12
IUPAC Name3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
SMILESCNc1c(F)cc(C(=O)NC(C)c2ccc(C)o2)cc1F
InChIInChI=1S/C15H16F2N2O2/c1-8-4-5-13(21-8)9(2)19-15(20)10-6-11(16)14(18-3)12(17)7-10/h4-7,9,18H,1-3H3,(H,19,20)
InChIKeyDUTIPHSYDYTSIO-UHFFFAOYSA-N
XLogP3.40
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.30
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-difluoro-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 46443441
3-fluoro-4-methyl-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 51232444
6-fluoro-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
CID 63977964
4-hydroxy-3-methyl-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 103951699
3,4-dimethyl-N-[(1R)-1-(5-methylfuran-2-yl)ethyl]-5-(methylsulfamoyl)benzamide
CID 31001991
3-amino-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 43703392
3,4-dimethoxy-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 46494747
N-[(1S)-1-(5-methylfuran-2-yl)ethyl]-4-[(S)-methylsulfinyl]benzamide
CID 94679161
4-fluoro-2-iodo-N-[1-(5-methylfuran-2-yl)ethyl]benzamide
CID 47220104
N-(3,3-dimethylbutan-2-yl)-3,5-difluoro-4-(methylamino)benzamide
CID 104829894
5-methyl-N-[(1R)-1-(5-methylfuran-2-yl)ethyl]-1,2-oxazole-3-carboxamide
CID 94177083
N-[1-(5-methylfuran-2-yl)ethyl]-1H-indole-6-carboxamide
CID 47190593

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide?
The IUPAC name of 3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide (CID 63185216) is 3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide.
What is the SMILES notation for 3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide?
The canonical SMILES for 3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide is CNc1c(F)cc(C(=O)NC(C)c2ccc(C)o2)cc1F.
What is the InChIKey of 3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide?
The InChIKey is DUTIPHSYDYTSIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N2O2/c1-8-4-5-13(21-8)9(2)19-15(20)10-6-11(16)14(18-3)12(17)7-10/h4-7,9,18H,1-3H3,(H,19,20).
What are the key properties of 3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide?
3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide has a molecular weight of 294.30 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-4-(methylamino)-N-[1-(5-methylfuran-2-yl)ethyl]benzamide is sourced from PubChem (CID 63185216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).