2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide

C18H14ClFN2O2 — CID 56724069

IUPAC2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(c1c(F)cccc1Cl)N(Cc1ccccn1)Cc1ccco1
InChIInChI=1S/C18H14ClFN2O2/c19-15-7-3-8-16(20)17(15)18(23)22(12-14-6-4-10-24-14)11-13-5-1-2-9-21-13/h1-10H,11-12H2
InChIKeyHGKRDKCLEZIVFR-UHFFFAOYSA-N
MW344.77 g/mol
LogP4.31
Rot. Bonds5

About 2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide

2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 56724069) has the molecular formula C18H14ClFN2O2 and a molecular weight of 344.77 g/mol. Its IUPAC name is 2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide
PubChem CID56724069
Molecular FormulaC18H14ClFN2O2
Molecular Weight344.77 g/mol
Exact Mass344.07
IUPAC Name2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(c1c(F)cccc1Cl)N(Cc1ccccn1)Cc1ccco1
InChIInChI=1S/C18H14ClFN2O2/c19-15-7-3-8-16(20)17(15)18(23)22(12-14-6-4-10-24-14)11-13-5-1-2-9-21-13/h1-10H,11-12H2
InChIKeyHGKRDKCLEZIVFR-UHFFFAOYSA-N
XLogP4.31
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.77
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide (CID 56724069) is 2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide is O=C(c1c(F)cccc1Cl)N(Cc1ccccn1)Cc1ccco1.
What is the InChIKey of 2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is HGKRDKCLEZIVFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClFN2O2/c19-15-7-3-8-16(20)17(15)18(23)22(12-14-6-4-10-24-14)11-13-5-1-2-9-21-13/h1-10H,11-12H2.
What are the key properties of 2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide?
2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 344.77 g/mol, XLogP of 4.31, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-fluoro-N-(furan-2-ylmethyl)-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 56724069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).