N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide

C21H17FN2O2 — CID 121363981

IUPACN-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide
SMILESCc1cc(F)ccc1CC(=O)Nc1ccc2c(c1)OCc1cnccc1-2
InChIInChI=1S/C21H17FN2O2/c1-13-8-16(22)3-2-14(13)9-21(25)24-17-4-5-19-18-6-7-23-11-15(18)12-26-20(19)10-17/h2-8,10-11H,9,12H2,1H3,(H,24,25)
InChIKeyORXMBZPQYXDQQX-UHFFFAOYSA-N
MW348.38 g/mol
LogP4.27
Rot. Bonds3

About N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide

N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide (PubChem CID 121363981) has the molecular formula C21H17FN2O2 and a molecular weight of 348.38 g/mol. Its IUPAC name is N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide
PubChem CID121363981
Molecular FormulaC21H17FN2O2
Molecular Weight348.38 g/mol
Exact Mass348.13
IUPAC NameN-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide
SMILESCc1cc(F)ccc1CC(=O)Nc1ccc2c(c1)OCc1cnccc1-2
InChIInChI=1S/C21H17FN2O2/c1-13-8-16(22)3-2-14(13)9-21(25)24-17-4-5-19-18-6-7-23-11-15(18)12-26-20(19)10-17/h2-8,10-11H,9,12H2,1H3,(H,24,25)
InChIKeyORXMBZPQYXDQQX-UHFFFAOYSA-N
XLogP4.27
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.38
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide?
The IUPAC name of N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide (CID 121363981) is N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide.
What is the SMILES notation for N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide?
The canonical SMILES for N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide is Cc1cc(F)ccc1CC(=O)Nc1ccc2c(c1)OCc1cnccc1-2.
What is the InChIKey of N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide?
The InChIKey is ORXMBZPQYXDQQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FN2O2/c1-13-8-16(22)3-2-14(13)9-21(25)24-17-4-5-19-18-6-7-23-11-15(18)12-26-20(19)10-17/h2-8,10-11H,9,12H2,1H3,(H,24,25).
What are the key properties of N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide?
N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide has a molecular weight of 348.38 g/mol, XLogP of 4.27, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5H-chromeno[3,4-c]pyridin-8-yl)-2-(4-fluoro-2-methylphenyl)acetamide is sourced from PubChem (CID 121363981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).