9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide

C21H20F2N2O2 — CID 170299334

IUPAC9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide
SMILESCC1CCCN1C(=O)CNC(=O)c1ccc2c(c1)-c1ccccc1C2(F)F
InChIInChI=1S/C21H20F2N2O2/c1-13-5-4-10-25(13)19(26)12-24-20(27)14-8-9-18-16(11-14)15-6-2-3-7-17(15)21(18,22)23/h2-3,6-9,11,13H,4-5,10,12H2,1H3,(H,24,27)
InChIKeyMEUMQUOLDKWJMA-UHFFFAOYSA-N
MW370.40 g/mol
LogP3.55
Rot. Bonds3

About 9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide

9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide (PubChem CID 170299334) has the molecular formula C21H20F2N2O2 and a molecular weight of 370.40 g/mol. Its IUPAC name is 9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide.

Molecular Properties

Compound Name9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide
PubChem CID170299334
Molecular FormulaC21H20F2N2O2
Molecular Weight370.40 g/mol
Exact Mass370.15
IUPAC Name9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide
SMILESCC1CCCN1C(=O)CNC(=O)c1ccc2c(c1)-c1ccccc1C2(F)F
InChIInChI=1S/C21H20F2N2O2/c1-13-5-4-10-25(13)19(26)12-24-20(27)14-8-9-18-16(11-14)15-6-2-3-7-17(15)21(18,22)23/h2-3,6-9,11,13H,4-5,10,12H2,1H3,(H,24,27)
InChIKeyMEUMQUOLDKWJMA-UHFFFAOYSA-N
XLogP3.55
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.40
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide?
The IUPAC name of 9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide (CID 170299334) is 9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide.
What is the SMILES notation for 9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide?
The canonical SMILES for 9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide is CC1CCCN1C(=O)CNC(=O)c1ccc2c(c1)-c1ccccc1C2(F)F.
What is the InChIKey of 9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide?
The InChIKey is MEUMQUOLDKWJMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20F2N2O2/c1-13-5-4-10-25(13)19(26)12-24-20(27)14-8-9-18-16(11-14)15-6-2-3-7-17(15)21(18,22)23/h2-3,6-9,11,13H,4-5,10,12H2,1H3,(H,24,27).
What are the key properties of 9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide?
9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide has a molecular weight of 370.40 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-difluoro-N-[2-(2-methylpyrrolidin-1-yl)-2-oxoethyl]fluorene-3-carboxamide is sourced from PubChem (CID 170299334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).