N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide

C13H17FN2O2 — CID 62334905

IUPACN-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide
SMILESO=C(COCC1CCCN1)Nc1ccc(F)cc1
InChIInChI=1S/C13H17FN2O2/c14-10-3-5-11(6-4-10)16-13(17)9-18-8-12-2-1-7-15-12/h3-6,12,15H,1-2,7-9H2,(H,16,17)
InChIKeyZQLPEULASGRKKB-UHFFFAOYSA-N
MW252.29 g/mol
LogP1.53
Rot. Bonds5

About N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide

N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide (PubChem CID 62334905) has the molecular formula C13H17FN2O2 and a molecular weight of 252.29 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide
PubChem CID62334905
Molecular FormulaC13H17FN2O2
Molecular Weight252.29 g/mol
Exact Mass252.13
IUPAC NameN-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide
SMILESO=C(COCC1CCCN1)Nc1ccc(F)cc1
InChIInChI=1S/C13H17FN2O2/c14-10-3-5-11(6-4-10)16-13(17)9-18-8-12-2-1-7-15-12/h3-6,12,15H,1-2,7-9H2,(H,16,17)
InChIKeyZQLPEULASGRKKB-UHFFFAOYSA-N
XLogP1.53
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.29
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluorophenyl)-2-(2-piperidin-2-ylethoxy)acetamide
CID 62343782
N-(4-fluorophenyl)-2-[propan-2-yl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106614350
N-(4-fluorophenyl)-2-piperidin-4-yloxyacetamide
CID 39062765
N-(4-fluorophenyl)-2-[2-hydroxyethyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106617853
N-(4-fluorophenyl)-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106615599
N-(4-acetamidophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119669050
N-(4-fluorophenyl)-2-[4-(2-pyrrolidin-2-ylacetyl)piperazin-1-yl]acetamide;dihydrochloride
CID 119833345
N-(4-fluorophenyl)-2-[methyl(2-piperidin-2-ylethyl)amino]acetamide
CID 66273842
N-(4-chlorophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119671239
N-prop-2-ynyl-2-(pyrrolidin-2-ylmethoxy)acetamide
CID 62333238
3-(4-fluorophenyl)-1-methyl-1-(piperidin-2-ylmethyl)urea
CID 106629819
N-(3-fluorophenyl)-2-pyrrolidin-2-ylacetamide
CID 61371784

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide (CID 62334905) is N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide is O=C(COCC1CCCN1)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide?
The InChIKey is ZQLPEULASGRKKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O2/c14-10-3-5-11(6-4-10)16-13(17)9-18-8-12-2-1-7-15-12/h3-6,12,15H,1-2,7-9H2,(H,16,17).
What are the key properties of N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide?
N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide has a molecular weight of 252.29 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-(pyrrolidin-2-ylmethoxy)acetamide is sourced from PubChem (CID 62334905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).