(3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide

C11H13FN2O — CID 94915553

IUPAC(3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1ccccc1F)[C@@H]1CCNC1
InChIInChI=1S/C11H13FN2O/c12-9-3-1-2-4-10(9)14-11(15)8-5-6-13-7-8/h1-4,8,13H,5-7H2,(H,14,15)/t8-/m1/s1
InChIKeyHDTOSKHUVQSCOV-MRVPVSSYSA-N
MW208.24 g/mol
LogP1.37
Rot. Bonds2

About (3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide

(3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide (PubChem CID 94915553) has the molecular formula C11H13FN2O and a molecular weight of 208.24 g/mol. Its IUPAC name is (3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide
PubChem CID94915553
Molecular FormulaC11H13FN2O
Molecular Weight208.24 g/mol
Exact Mass208.10
IUPAC Name(3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1ccccc1F)[C@@H]1CCNC1
InChIInChI=1S/C11H13FN2O/c12-9-3-1-2-4-10(9)14-11(15)8-5-6-13-7-8/h1-4,8,13H,5-7H2,(H,14,15)/t8-/m1/s1
InChIKeyHDTOSKHUVQSCOV-MRVPVSSYSA-N
XLogP1.37
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.24
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-chloro-2-fluorophenyl)pyrrolidine-3-carboxamide
CID 63007340
(3R)-N-(2-methylphenyl)pyrrolidine-3-carboxamide
CID 94915623
N-(2,4,5-trifluorophenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119708623
N-(2-methylsulfanylphenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119674755
3-fluoro-4-(pyrrolidine-3-carbonylamino)benzoic acid
CID 63188319
N-(4-bromo-2-fluorophenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119673458
(3S)-N-(5-chloro-2-fluorophenyl)piperidine-3-carboxamide
CID 81124041
N-(2-methoxyphenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119670539
methyl 4-fluoro-3-(pyrrolidine-3-carbonylamino)benzoate
CID 63007212
N-(2-propan-2-ylsulfanylphenyl)pyrrolidine-3-carboxamide
CID 119798016
N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
CID 63006645
N-(2-fluoro-4-propan-2-yloxyphenyl)pyrrolidine-3-carboxamide
CID 119757906

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide?
The IUPAC name of (3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide (CID 94915553) is (3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide?
The canonical SMILES for (3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide is O=C(Nc1ccccc1F)[C@@H]1CCNC1.
What is the InChIKey of (3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide?
The InChIKey is HDTOSKHUVQSCOV-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H13FN2O/c12-9-3-1-2-4-10(9)14-11(15)8-5-6-13-7-8/h1-4,8,13H,5-7H2,(H,14,15)/t8-/m1/s1.
What are the key properties of (3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide?
(3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide has a molecular weight of 208.24 g/mol, XLogP of 1.37, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 94915553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).