6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide

C16H11F2NO2 — CID 146123471

IUPAC6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1=Cc2cc(F)ccc2OC1
InChIInChI=1S/C16H11F2NO2/c17-12-1-4-14(5-2-12)19-16(20)11-7-10-8-13(18)3-6-15(10)21-9-11/h1-8H,9H2,(H,19,20)
InChIKeyOMUIWJBWQFEWOL-UHFFFAOYSA-N
MW287.27 g/mol
LogP3.38
Rot. Bonds2

About 6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide

6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide (PubChem CID 146123471) has the molecular formula C16H11F2NO2 and a molecular weight of 287.27 g/mol. Its IUPAC name is 6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide.

Molecular Properties

Compound Name6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide
PubChem CID146123471
Molecular FormulaC16H11F2NO2
Molecular Weight287.27 g/mol
Exact Mass287.08
IUPAC Name6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1=Cc2cc(F)ccc2OC1
InChIInChI=1S/C16H11F2NO2/c17-12-1-4-14(5-2-12)19-16(20)11-7-10-8-13(18)3-6-15(10)21-9-11/h1-8H,9H2,(H,19,20)
InChIKeyOMUIWJBWQFEWOL-UHFFFAOYSA-N
XLogP3.38
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.27
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-chloro-N-(2,5-difluorophenyl)-2H-chromene-3-carboxamide
CID 24517965
N-(3,4-difluorophenyl)-2H-chromene-3-carboxamide
CID 26736929
6-fluoro-N-(1-hydroxy-2-methylpropan-2-yl)-2H-chromene-3-carboxamide
CID 110000594
N-(4-acetamidophenyl)-2H-chromene-3-carboxamide
CID 7465016
N-(4-acetylphenyl)-2H-chromene-3-carboxamide
CID 9042646
N-(3,5-dimethoxyphenyl)-6-ethoxy-2H-chromene-3-carboxamide
CID 46488602
N-[4-(2-methylpropanoylamino)phenyl]-2H-chromene-3-carboxamide
CID 26782775
N-(4-fluorophenyl)-3,3-dimethyl-2,4-dihydro-1,5-benzodioxepine-7-carboxamide
CID 100603181
N-(3-methylphenyl)-2H-chromene-3-carboxamide
CID 7464936
N-[4-(4-fluoroanilino)phenyl]-1,3-benzodioxole-5-carboxamide
CID 112986861
N-(2-fluorophenyl)-2H-chromene-3-carboxamide
CID 7464960
N-(3,4-dimethoxyphenyl)-6-ethoxy-2H-chromene-3-carboxamide
CID 46484911

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide?
The IUPAC name of 6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide (CID 146123471) is 6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide.
What is the SMILES notation for 6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide?
The canonical SMILES for 6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide is O=C(Nc1ccc(F)cc1)C1=Cc2cc(F)ccc2OC1.
What is the InChIKey of 6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide?
The InChIKey is OMUIWJBWQFEWOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F2NO2/c17-12-1-4-14(5-2-12)19-16(20)11-7-10-8-13(18)3-6-15(10)21-9-11/h1-8H,9H2,(H,19,20).
What are the key properties of 6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide?
6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide has a molecular weight of 287.27 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(4-fluorophenyl)-2H-chromene-3-carboxamide is sourced from PubChem (CID 146123471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).