N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide

C14H19FN2O2 — CID 62736577

IUPACN-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide
SMILESO=C(CCN1CCC[C@@H]1CO)Nc1cccc(F)c1
InChIInChI=1S/C14H19FN2O2/c15-11-3-1-4-12(9-11)16-14(19)6-8-17-7-2-5-13(17)10-18/h1,3-4,9,13,18H,2,5-8,10H2,(H,16,19)/t13-/m1/s1
InChIKeyCNYUTSWIOKLFIJ-CYBMUJFWSA-N
MW266.32 g/mol
LogP1.61
Rot. Bonds5

About N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide

N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide (PubChem CID 62736577) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide
PubChem CID62736577
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC NameN-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide
SMILESO=C(CCN1CCC[C@@H]1CO)Nc1cccc(F)c1
InChIInChI=1S/C14H19FN2O2/c15-11-3-1-4-12(9-11)16-14(19)6-8-17-7-2-5-13(17)10-18/h1,3-4,9,13,18H,2,5-8,10H2,(H,16,19)/t13-/m1/s1
InChIKeyCNYUTSWIOKLFIJ-CYBMUJFWSA-N
XLogP1.61
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-fluorophenyl)-2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]acetamide
CID 62046362
N-[3-(aminomethyl)phenyl]-3-[2-(hydroxymethyl)pyrrolidin-1-yl]propanamide
CID 61407186
N-(3-chlorophenyl)-3-[2-(hydroxymethyl)azepan-1-yl]propanamide
CID 116637464
N-(2-amino-4-fluorophenyl)-3-[2-(hydroxymethyl)pyrrolidin-1-yl]propanamide
CID 61407328
N-(3-amino-4-fluorophenyl)-3-[2-(hydroxymethyl)piperidin-1-yl]propanamide
CID 61406991
N-(2-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide
CID 78917112
N-(2-fluorophenyl)-3-[2-(hydroxymethyl)pyrrolidin-1-yl]propanamide
CID 62014163
N-(3-fluorophenyl)-3-[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]propanamide
CID 124752690
N-(3-fluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide
CID 43037946
N-(3-fluorophenyl)-3-[2-(5-methyl-1,3,4-oxadiazol-2-yl)pyrrolidin-1-yl]propanamide
CID 71846093
N-(3,5-difluorophenyl)-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]acetamide
CID 78942185
N-(3-fluorophenyl)-2-[2-(methylaminomethyl)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119928586

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide?
The IUPAC name of N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide (CID 62736577) is N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide.
What is the SMILES notation for N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide?
The canonical SMILES for N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide is O=C(CCN1CCC[C@@H]1CO)Nc1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide?
The InChIKey is CNYUTSWIOKLFIJ-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H19FN2O2/c15-11-3-1-4-12(9-11)16-14(19)6-8-17-7-2-5-13(17)10-18/h1,3-4,9,13,18H,2,5-8,10H2,(H,16,19)/t13-/m1/s1.
What are the key properties of N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide?
N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide has a molecular weight of 266.32 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-3-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]propanamide is sourced from PubChem (CID 62736577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).