2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide

C22H17FN2O2 — CID 127039060

IUPAC2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide
SMILESCc1ccc2c(c1)-c1ccccc1C2NC(=O)NC(=O)c1ccccc1F
InChIInChI=1S/C22H17FN2O2/c1-13-10-11-16-18(12-13)14-6-2-3-7-15(14)20(16)24-22(27)25-21(26)17-8-4-5-9-19(17)23/h2-12,20H,1H3,(H2,24,25,26,27)
InChIKeyJSTUMKDLOONFHJ-UHFFFAOYSA-N
MW360.39 g/mol
LogP4.34
Rot. Bonds2

About 2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide

2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide (PubChem CID 127039060) has the molecular formula C22H17FN2O2 and a molecular weight of 360.39 g/mol. Its IUPAC name is 2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide
PubChem CID127039060
Molecular FormulaC22H17FN2O2
Molecular Weight360.39 g/mol
Exact Mass360.13
IUPAC Name2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide
SMILESCc1ccc2c(c1)-c1ccccc1C2NC(=O)NC(=O)c1ccccc1F
InChIInChI=1S/C22H17FN2O2/c1-13-10-11-16-18(12-13)14-6-2-3-7-15(14)20(16)24-22(27)25-21(26)17-8-4-5-9-19(17)23/h2-12,20H,1H3,(H2,24,25,26,27)
InChIKeyJSTUMKDLOONFHJ-UHFFFAOYSA-N
XLogP4.34
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.39
LogP ≤ 54.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide?
The IUPAC name of 2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide (CID 127039060) is 2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide?
The canonical SMILES for 2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide is Cc1ccc2c(c1)-c1ccccc1C2NC(=O)NC(=O)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide?
The InChIKey is JSTUMKDLOONFHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17FN2O2/c1-13-10-11-16-18(12-13)14-6-2-3-7-15(14)20(16)24-22(27)25-21(26)17-8-4-5-9-19(17)23/h2-12,20H,1H3,(H2,24,25,26,27).
What are the key properties of 2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide?
2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide has a molecular weight of 360.39 g/mol, XLogP of 4.34, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[(3-methyl-9H-fluoren-9-yl)carbamoyl]benzamide is sourced from PubChem (CID 127039060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).