3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide

C10H18FN3O — CID 54450911

IUPAC3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide
SMILESO=C(NC1CCCCN1)N1CCC(F)C1
InChIInChI=1S/C10H18FN3O/c11-8-4-6-14(7-8)10(15)13-9-3-1-2-5-12-9/h8-9,12H,1-7H2,(H,13,15)
InChIKeyWUXHUBVCOFDLEO-UHFFFAOYSA-N
MW215.27 g/mol
LogP0.84
Rot. Bonds1

About 3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide

3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide (PubChem CID 54450911) has the molecular formula C10H18FN3O and a molecular weight of 215.27 g/mol. Its IUPAC name is 3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide
PubChem CID54450911
Molecular FormulaC10H18FN3O
Molecular Weight215.27 g/mol
Exact Mass215.14
IUPAC Name3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide
SMILESO=C(NC1CCCCN1)N1CCC(F)C1
InChIInChI=1S/C10H18FN3O/c11-8-4-6-14(7-8)10(15)13-9-3-1-2-5-12-9/h8-9,12H,1-7H2,(H,13,15)
InChIKeyWUXHUBVCOFDLEO-UHFFFAOYSA-N
XLogP0.84
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.27
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoropyrrolidine-1-carbohydrazide
CID 155317183
N-cyclopentyl-3-hydroxy-4-methylpiperidine-1-carboxamide
CID 103896284
3-fluoro-N-methoxyazepane-1-carboxamide
CID 131177037
(3R)-3-amino-N-cyclopentylpyrrolidine-1-carboxamide
CID 115301653
3-fluoropyrrolidine-1-carboxylic acid
CID 21071719
3-fluoropyrrolidine-1-carbonyl chloride
CID 175546868
2-[(3-hydroxy-4-methylpiperidine-1-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 102962212
(3R)-N-cyclohexyl-3-methylpyrrolidine-1-carboxamide
CID 66581198
N-cyclopropyl-3-hydroxypyrrolidine-1-carboxamide
CID 62916085
3-methyl-N-(2-methylpiperidin-3-yl)piperidine-1-carboxamide
CID 79159344
(4-aminopiperidin-1-yl)-[(2S)-piperidin-2-yl]methanone
CID 154266528
N-cyclopentyl-3-(dimethylamino)pyrrolidine-1-carboxamide
CID 115610399

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide?
The IUPAC name of 3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide (CID 54450911) is 3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide.
What is the SMILES notation for 3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide?
The canonical SMILES for 3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide is O=C(NC1CCCCN1)N1CCC(F)C1.
What is the InChIKey of 3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide?
The InChIKey is WUXHUBVCOFDLEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18FN3O/c11-8-4-6-14(7-8)10(15)13-9-3-1-2-5-12-9/h8-9,12H,1-7H2,(H,13,15).
What are the key properties of 3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide?
3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide has a molecular weight of 215.27 g/mol, XLogP of 0.84, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-piperidin-2-ylpyrrolidine-1-carboxamide is sourced from PubChem (CID 54450911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).