1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide

C13H15FN2O2 — CID 61051030

IUPAC1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1C(=O)c1ccccc1F
InChIInChI=1S/C13H15FN2O2/c1-15-12(17)11-7-4-8-16(11)13(18)9-5-2-3-6-10(9)14/h2-3,5-6,11H,4,7-8H2,1H3,(H,15,17)
InChIKeyAHGYJQBZRBGTIO-UHFFFAOYSA-N
MW250.27 g/mol
LogP1.18
Rot. Bonds2

About 1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide

1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide (PubChem CID 61051030) has the molecular formula C13H15FN2O2 and a molecular weight of 250.27 g/mol. Its IUPAC name is 1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide
PubChem CID61051030
Molecular FormulaC13H15FN2O2
Molecular Weight250.27 g/mol
Exact Mass250.11
IUPAC Name1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1C(=O)c1ccccc1F
InChIInChI=1S/C13H15FN2O2/c1-15-12(17)11-7-4-8-16(11)13(18)9-5-2-3-6-10(9)14/h2-3,5-6,11H,4,7-8H2,1H3,(H,15,17)
InChIKeyAHGYJQBZRBGTIO-UHFFFAOYSA-N
XLogP1.18
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.27
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-(2,6-difluorophenyl)-1-(2-fluorobenzoyl)pyrrolidine-2-carboxamide
CID 51606058
(2S)-1-(2-fluorobenzoyl)-N-(4-methylphenyl)pyrrolidine-2-carboxamide
CID 92668196
1-(5-amino-2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide
CID 54978967
1-(2-fluorobenzoyl)pyrrolidine-2-carboxamide
CID 60659210
N-(4-chlorophenyl)-1-(2-fluorobenzoyl)pyrrolidine-2-carboxamide
CID 46748924
N-methyl-1-[2-[2-(methylamino)ethyl]benzoyl]pyrrolidine-2-carboxamide
CID 104547616
propyl 1-(2-fluorobenzoyl)pyrrolidine-2-carboxylate
CID 91711961
1-(1H-indole-3-carbonyl)-N-methylpyrrolidine-2-carboxamide
CID 60958469
1-(2-hydroxy-3-nitrobenzoyl)-N-methylpyrrolidine-2-carboxamide
CID 103800275
1-[3-(2-fluorophenyl)prop-2-enoyl]-N-methylpiperidine-2-carboxamide
CID 71897283
1-(4-amino-3-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide
CID 62681861
1-(2-chloropyridine-3-carbonyl)-N-methylpiperidine-2-carboxamide
CID 61052177

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide (CID 61051030) is 1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide is CNC(=O)C1CCCN1C(=O)c1ccccc1F.
What is the InChIKey of 1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide?
The InChIKey is AHGYJQBZRBGTIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN2O2/c1-15-12(17)11-7-4-8-16(11)13(18)9-5-2-3-6-10(9)14/h2-3,5-6,11H,4,7-8H2,1H3,(H,15,17).
What are the key properties of 1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide?
1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide has a molecular weight of 250.27 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorobenzoyl)-N-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 61051030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).