(2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide

C10H10FNO2 — CID 74983349

IUPAC(2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide
SMILESC[C@@H]1Cc2cc(F)cc(C(N)=O)c2O1
InChIInChI=1S/C10H10FNO2/c1-5-2-6-3-7(11)4-8(10(12)13)9(6)14-5/h3-5H,2H2,1H3,(H2,12,13)/t5-/m1/s1
InChIKeyZPHKBVTUIABAIO-RXMQYKEDSA-N
MW195.19 g/mol
LogP1.25
Rot. Bonds1

About (2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide

(2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide (PubChem CID 74983349) has the molecular formula C10H10FNO2 and a molecular weight of 195.19 g/mol. Its IUPAC name is (2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide.

Molecular Properties

Compound Name(2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide
PubChem CID74983349
Molecular FormulaC10H10FNO2
Molecular Weight195.19 g/mol
Exact Mass195.07
IUPAC Name(2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide
SMILESC[C@@H]1Cc2cc(F)cc(C(N)=O)c2O1
InChIInChI=1S/C10H10FNO2/c1-5-2-6-3-7(11)4-8(10(12)13)9(6)14-5/h3-5H,2H2,1H3,(H2,12,13)/t5-/m1/s1
InChIKeyZPHKBVTUIABAIO-RXMQYKEDSA-N
XLogP1.25
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.19
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide?
The IUPAC name of (2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide (CID 74983349) is (2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide.
What is the SMILES notation for (2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide?
The canonical SMILES for (2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide is C[C@@H]1Cc2cc(F)cc(C(N)=O)c2O1.
What is the InChIKey of (2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide?
The InChIKey is ZPHKBVTUIABAIO-RXMQYKEDSA-N. The full InChI is InChI=1S/C10H10FNO2/c1-5-2-6-3-7(11)4-8(10(12)13)9(6)14-5/h3-5H,2H2,1H3,(H2,12,13)/t5-/m1/s1.
What are the key properties of (2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide?
(2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide has a molecular weight of 195.19 g/mol, XLogP of 1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5-fluoro-2-methyl-2,3-dihydro-1-benzofuran-7-carboxamide is sourced from PubChem (CID 74983349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).