(5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide

C18H19FN2O2 — CID 134692551

IUPAC(5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide
SMILESNC(=O)C1CC[C@H](c2ccc(OCc3ccccc3F)cc2)N1
InChIInChI=1S/C18H19FN2O2/c19-15-4-2-1-3-13(15)11-23-14-7-5-12(6-8-14)16-9-10-17(21-16)18(20)22/h1-8,16-17,21H,9-11H2,(H2,20,22)/t16-,17?/m1/s1
InChIKeyJESCETIFNOFKEU-TZHYSIJRSA-N
MW314.36 g/mol
LogP2.68
Rot. Bonds5

About (5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide

(5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide (PubChem CID 134692551) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is (5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide
PubChem CID134692551
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC Name(5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide
SMILESNC(=O)C1CC[C@H](c2ccc(OCc3ccccc3F)cc2)N1
InChIInChI=1S/C18H19FN2O2/c19-15-4-2-1-3-13(15)11-23-14-7-5-12(6-8-14)16-9-10-17(21-16)18(20)22/h1-8,16-17,21H,9-11H2,(H2,20,22)/t16-,17?/m1/s1
InChIKeyJESCETIFNOFKEU-TZHYSIJRSA-N
XLogP2.68
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]-1-phosphanylpyrrolidine-2-carboxamide;(2S,5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide;methane;hydroiodide
CID 158797664
5-[2-[(2-fluorophenyl)methoxy]pyrimidin-5-yl]pyrrolidine-2-carboxamide
CID 122578512
(2S)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidin-1-ium-2-carboxamide
CID 164788192
cis-(1R,3S)-3-[4-[(2-fluorophenyl)methoxy]phenyl]cyclopentane-1-carboxamide
CID 161335491
1-[5-[6-[(2-fluorophenyl)methoxy]-3-pyridinyl]pyrrolidin-2-yl]ethanone
CID 122578531
2-[[(1S,2S)-2-[4-[(2-fluorophenyl)methoxy]phenyl]cyclopentyl]amino]acetamide
CID 90489760
methyl (2R,5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]-2-(methoxymethyl)pyrrolidine-2-carboxylate
CID 71054465
(2R,5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]-2-(methoxymethyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 25064010
(2R,5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]-2-(methoxymethyl)-N-methylpyrrolidine-2-carboxamide
CID 24983463
(2S,5R)-5-[4-[(2-fluorophenyl)methoxy]cyclohexa-2,4-dien-1-yl]pyrrolidine-2-carboxamide
CID 155203580
4-[(2-fluorophenyl)methoxy]-N-[(2R,3S,4S)-3-hydroxy-2-(hydroxymethyl)oxan-4-yl]benzamide
CID 146038093
5-[4-[(2-fluorophenyl)methoxy]phenyl]oxolan-2-one
CID 25178378

Frequently Asked Questions

What is the IUPAC name of (5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide?
The IUPAC name of (5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide (CID 134692551) is (5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide is NC(=O)C1CC[C@H](c2ccc(OCc3ccccc3F)cc2)N1.
What is the InChIKey of (5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide?
The InChIKey is JESCETIFNOFKEU-TZHYSIJRSA-N. The full InChI is InChI=1S/C18H19FN2O2/c19-15-4-2-1-3-13(15)11-23-14-7-5-12(6-8-14)16-9-10-17(21-16)18(20)22/h1-8,16-17,21H,9-11H2,(H2,20,22)/t16-,17?/m1/s1.
What are the key properties of (5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide?
(5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide has a molecular weight of 314.36 g/mol, XLogP of 2.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-[4-[(2-fluorophenyl)methoxy]phenyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 134692551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).