N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide

C16H11FN2O2 — CID 103874401

IUPACN-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide
SMILESO=C(Nc1ccncc1F)c1ccc2ccccc2c1O
InChIInChI=1S/C16H11FN2O2/c17-13-9-18-8-7-14(13)19-16(21)12-6-5-10-3-1-2-4-11(10)15(12)20/h1-9,20H,(H,18,19,21)
InChIKeyYXCKXNIFHBZRTG-UHFFFAOYSA-N
MW282.27 g/mol
LogP3.33
Rot. Bonds2

About N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide

N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide (PubChem CID 103874401) has the molecular formula C16H11FN2O2 and a molecular weight of 282.27 g/mol. Its IUPAC name is N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide
PubChem CID103874401
Molecular FormulaC16H11FN2O2
Molecular Weight282.27 g/mol
Exact Mass282.08
IUPAC NameN-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide
SMILESO=C(Nc1ccncc1F)c1ccc2ccccc2c1O
InChIInChI=1S/C16H11FN2O2/c17-13-9-18-8-7-14(13)19-16(21)12-6-5-10-3-1-2-4-11(10)15(12)20/h1-9,20H,(H,18,19,21)
InChIKeyYXCKXNIFHBZRTG-UHFFFAOYSA-N
XLogP3.33
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.27
LogP ≤ 53.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide?
The IUPAC name of N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide (CID 103874401) is N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide?
The canonical SMILES for N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide is O=C(Nc1ccncc1F)c1ccc2ccccc2c1O.
What is the InChIKey of N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide?
The InChIKey is YXCKXNIFHBZRTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN2O2/c17-13-9-18-8-7-14(13)19-16(21)12-6-5-10-3-1-2-4-11(10)15(12)20/h1-9,20H,(H,18,19,21).
What are the key properties of N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide?
N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide has a molecular weight of 282.27 g/mol, XLogP of 3.33, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-pyridinyl)-1-hydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 103874401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).