5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide

C18H17F3N2O3 — CID 22145901

IUPAC5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide
SMILESCOc1cc(F)c(C(=O)Nc2c(F)cncc2F)cc1OC1CCCC1
InChIInChI=1S/C18H17F3N2O3/c1-25-15-7-12(19)11(6-16(15)26-10-4-2-3-5-10)18(24)23-17-13(20)8-22-9-14(17)21/h6-10H,2-5H2,1H3,(H,22,23,24)
InChIKeyZUGGUXQTMNSNQD-UHFFFAOYSA-N
MW366.34 g/mol
LogP4.08
Rot. Bonds5

About 5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide

5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide (PubChem CID 22145901) has the molecular formula C18H17F3N2O3 and a molecular weight of 366.34 g/mol. Its IUPAC name is 5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide.

Molecular Properties

Compound Name5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide
PubChem CID22145901
Molecular FormulaC18H17F3N2O3
Molecular Weight366.34 g/mol
Exact Mass366.12
IUPAC Name5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide
SMILESCOc1cc(F)c(C(=O)Nc2c(F)cncc2F)cc1OC1CCCC1
InChIInChI=1S/C18H17F3N2O3/c1-25-15-7-12(19)11(6-16(15)26-10-4-2-3-5-10)18(24)23-17-13(20)8-22-9-14(17)21/h6-10H,2-5H2,1H3,(H,22,23,24)
InChIKeyZUGGUXQTMNSNQD-UHFFFAOYSA-N
XLogP4.08
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.34
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide?
The IUPAC name of 5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide (CID 22145901) is 5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide.
What is the SMILES notation for 5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide?
The canonical SMILES for 5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide is COc1cc(F)c(C(=O)Nc2c(F)cncc2F)cc1OC1CCCC1.
What is the InChIKey of 5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide?
The InChIKey is ZUGGUXQTMNSNQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F3N2O3/c1-25-15-7-12(19)11(6-16(15)26-10-4-2-3-5-10)18(24)23-17-13(20)8-22-9-14(17)21/h6-10H,2-5H2,1H3,(H,22,23,24).
What are the key properties of 5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide?
5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide has a molecular weight of 366.34 g/mol, XLogP of 4.08, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyloxy-N-(3,5-difluoro-4-pyridinyl)-2-fluoro-4-methoxybenzamide is sourced from PubChem (CID 22145901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).