2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide

C15H15F2NO2 — CID 62661107

IUPAC2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide
SMILESCC(CCc1ccco1)NC(=O)c1cccc(F)c1F
InChIInChI=1S/C15H15F2NO2/c1-10(7-8-11-4-3-9-20-11)18-15(19)12-5-2-6-13(16)14(12)17/h2-6,9-10H,7-8H2,1H3,(H,18,19)
InChIKeyBKIBCFPPGOCZMJ-UHFFFAOYSA-N
MW279.29 g/mol
LogP3.31
Rot. Bonds5

About 2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide

2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide (PubChem CID 62661107) has the molecular formula C15H15F2NO2 and a molecular weight of 279.29 g/mol. Its IUPAC name is 2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide.

Molecular Properties

Compound Name2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide
PubChem CID62661107
Molecular FormulaC15H15F2NO2
Molecular Weight279.29 g/mol
Exact Mass279.11
IUPAC Name2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide
SMILESCC(CCc1ccco1)NC(=O)c1cccc(F)c1F
InChIInChI=1S/C15H15F2NO2/c1-10(7-8-11-4-3-9-20-11)18-15(19)12-5-2-6-13(16)14(12)17/h2-6,9-10H,7-8H2,1H3,(H,18,19)
InChIKeyBKIBCFPPGOCZMJ-UHFFFAOYSA-N
XLogP3.31
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.29
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-N-[4-(furan-2-yl)butan-2-yl]-4-methylbenzamide
CID 79769993
4-fluoro-N-[4-(furan-2-yl)butan-2-yl]-2-methylbenzamide
CID 115745188
N-[4-(furan-2-yl)butan-2-yl]-2-methoxybenzamide
CID 18162458
3,5-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide
CID 18162420
2,3-difluoro-N-hexan-2-ylbenzamide
CID 55099872
2-(difluoromethylsulfanyl)-N-[4-(furan-2-yl)butan-2-yl]pyridine-3-carboxamide
CID 24641935
N-(1-chloropropan-2-yl)-2,3-difluorobenzamide
CID 114299570
N-[4-(furan-2-yl)butan-2-yl]-3,5-dihydroxybenzamide
CID 104938782
3-amino-N-[4-(furan-2-yl)butan-2-yl]benzamide
CID 61249559
N-[(2S)-4-(furan-2-yl)butan-2-yl]-2-morpholin-4-ylbenzamide
CID 95132894
N-[4-(furan-2-yl)butan-2-yl]-2-(methylamino)acetamide
CID 61249906
1-(2,3-difluorophenyl)-3-(furan-2-yl)propan-1-ol
CID 105099638

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide?
The IUPAC name of 2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide (CID 62661107) is 2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide.
What is the SMILES notation for 2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide?
The canonical SMILES for 2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide is CC(CCc1ccco1)NC(=O)c1cccc(F)c1F.
What is the InChIKey of 2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide?
The InChIKey is BKIBCFPPGOCZMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO2/c1-10(7-8-11-4-3-9-20-11)18-15(19)12-5-2-6-13(16)14(12)17/h2-6,9-10H,7-8H2,1H3,(H,18,19).
What are the key properties of 2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide?
2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide has a molecular weight of 279.29 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-N-[4-(furan-2-yl)butan-2-yl]benzamide is sourced from PubChem (CID 62661107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).