(3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone

C16H10FNO — CID 23070163

IUPAC(3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone
SMILESO=C(c1ccc2ccccc2c1)c1ncccc1F
InChIInChI=1S/C16H10FNO/c17-14-6-3-9-18-15(14)16(19)13-8-7-11-4-1-2-5-12(11)10-13/h1-10H
InChIKeyUZKOTJLBWFYWAV-UHFFFAOYSA-N
MW251.26 g/mol
LogP3.60
Rot. Bonds2

About (3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone

(3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone (PubChem CID 23070163) has the molecular formula C16H10FNO and a molecular weight of 251.26 g/mol. Its IUPAC name is (3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone.

Molecular Properties

Compound Name(3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone
PubChem CID23070163
Molecular FormulaC16H10FNO
Molecular Weight251.26 g/mol
Exact Mass251.07
IUPAC Name(3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone
SMILESO=C(c1ccc2ccccc2c1)c1ncccc1F
InChIInChI=1S/C16H10FNO/c17-14-6-3-9-18-15(14)16(19)13-8-7-11-4-1-2-5-12(11)10-13/h1-10H
InChIKeyUZKOTJLBWFYWAV-UHFFFAOYSA-N
XLogP3.60
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.26
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone?
The IUPAC name of (3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone (CID 23070163) is (3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone.
What is the SMILES notation for (3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone?
The canonical SMILES for (3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone is O=C(c1ccc2ccccc2c1)c1ncccc1F.
What is the InChIKey of (3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone?
The InChIKey is UZKOTJLBWFYWAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FNO/c17-14-6-3-9-18-15(14)16(19)13-8-7-11-4-1-2-5-12(11)10-13/h1-10H.
What are the key properties of (3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone?
(3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone has a molecular weight of 251.26 g/mol, XLogP of 3.60, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-2-pyridinyl)-naphthalen-2-ylmethanone is sourced from PubChem (CID 23070163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).