N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide

C14H11FN2O2 — CID 115497334

IUPACN-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide
SMILESO=C(Nc1ccc2c(c1)CCO2)c1cccc(F)n1
InChIInChI=1S/C14H11FN2O2/c15-13-3-1-2-11(17-13)14(18)16-10-4-5-12-9(8-10)6-7-19-12/h1-5,8H,6-7H2,(H,16,18)
InChIKeyDTGYOEYKWIBQDX-UHFFFAOYSA-N
MW258.25 g/mol
LogP2.41
Rot. Bonds2

About N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide

N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide (PubChem CID 115497334) has the molecular formula C14H11FN2O2 and a molecular weight of 258.25 g/mol. Its IUPAC name is N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide
PubChem CID115497334
Molecular FormulaC14H11FN2O2
Molecular Weight258.25 g/mol
Exact Mass258.08
IUPAC NameN-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide
SMILESO=C(Nc1ccc2c(c1)CCO2)c1cccc(F)n1
InChIInChI=1S/C14H11FN2O2/c15-13-3-1-2-11(17-13)14(18)16-10-4-5-12-9(8-10)6-7-19-12/h1-5,8H,6-7H2,(H,16,18)
InChIKeyDTGYOEYKWIBQDX-UHFFFAOYSA-N
XLogP2.41
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.25
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-bromo-N-(2,3-dihydro-1-benzofuran-5-yl)pyridine-2-carboxamide
CID 113346686
2,3-dichloro-N-(2,3-dihydro-1-benzofuran-5-yl)benzamide
CID 38558640
N-(2,3-dihydro-1-benzofuran-5-yl)naphthalene-1-carboxamide
CID 38558744
N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-6-fluoropyridine-2-carboxamide
CID 115497158
N-[3-(1,3-dioxolan-2-yl)phenyl]-6-fluoropyridine-2-carboxamide
CID 106911689
N-(4-carbamoylphenyl)-6-fluoropyridine-2-carboxamide
CID 115496681
2-chloro-N-(2,3-dihydro-1-benzofuran-5-yl)acetamide
CID 43701447
N-(2,3-dihydro-1-benzofuran-5-yl)-3-(dimethylamino)benzamide
CID 34441263
N-(2,3-dihydro-1-benzofuran-5-yl)-3-(3-fluorophenyl)propanamide
CID 34433022
1-(2,3-dihydro-1-benzofuran-5-yl)-3-(2-fluorophenyl)urea
CID 110866388
2,5-dichloro-N-(2,3-dihydro-1-benzofuran-5-yl)pyridine-4-carboxamide
CID 114917851
1-(3-bromophenyl)-3-(2,3-dihydro-1-benzofuran-5-yl)urea
CID 110866595

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide?
The IUPAC name of N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide (CID 115497334) is N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide.
What is the SMILES notation for N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide?
The canonical SMILES for N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide is O=C(Nc1ccc2c(c1)CCO2)c1cccc(F)n1.
What is the InChIKey of N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide?
The InChIKey is DTGYOEYKWIBQDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O2/c15-13-3-1-2-11(17-13)14(18)16-10-4-5-12-9(8-10)6-7-19-12/h1-5,8H,6-7H2,(H,16,18).
What are the key properties of N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide?
N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide has a molecular weight of 258.25 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1-benzofuran-5-yl)-6-fluoropyridine-2-carboxamide is sourced from PubChem (CID 115497334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).