2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide

C15H21FN2O — CID 119550385

IUPAC2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide
SMILESCN(C(=O)C(C)(C)c1cccc(F)c1)C1CCNC1
InChIInChI=1S/C15H21FN2O/c1-15(2,11-5-4-6-12(16)9-11)14(19)18(3)13-7-8-17-10-13/h4-6,9,13,17H,7-8,10H2,1-3H3
InChIKeySWCVJZLRGZWXKV-UHFFFAOYSA-N
MW264.34 g/mol
LogP1.92
Rot. Bonds3

About 2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide

2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide (PubChem CID 119550385) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide
PubChem CID119550385
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide
SMILESCN(C(=O)C(C)(C)c1cccc(F)c1)C1CCNC1
InChIInChI=1S/C15H21FN2O/c1-15(2,11-5-4-6-12(16)9-11)14(19)18(3)13-7-8-17-10-13/h4-6,9,13,17H,7-8,10H2,1-3H3
InChIKeySWCVJZLRGZWXKV-UHFFFAOYSA-N
XLogP1.92
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119549893
3-fluoro-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 60805996
N,2-dimethyl-N-pyrrolidin-3-yl-2-thiophen-2-ylpropanamide;hydrochloride
CID 119553530
2-(3-chloro-5-methylphenyl)-N,2-dimethyl-N-piperidin-4-ylpropanamide;ethene;1-fluoro-3-methylbenzene
CID 143200782
2-[3,5-bis(trifluoromethyl)phenyl]-N-[(3R,4R)-3-(4-fluorophenyl)piperidin-4-yl]-N,2-dimethylpropanamide
CID 58990677
2-(2-chlorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119551745
2-[3,5-bis(trifluoromethyl)phenyl]-N-[(3S,4S)-3-(4-fluoro-2-methylphenyl)piperidin-4-yl]-N,2-dimethylpropanamide
CID 58990758
N-methyl-N-pyrrolidin-3-yl-2-[3-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119553639
4-(3-fluorophenoxy)-N-methyl-N-pyrrolidin-3-ylbutanamide
CID 119553657
3-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119552777
2-[3,5-bis(trifluoromethyl)phenyl]-N,2-dimethyl-N-[(3S,4S)-3-(2-methylphenyl)piperidin-4-yl]propanamide
CID 58990699
2-methyl-2-phenyl-N-piperidin-4-yl-N-propylpropanamide
CID 60806254

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide?
The IUPAC name of 2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide (CID 119550385) is 2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide?
The canonical SMILES for 2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide is CN(C(=O)C(C)(C)c1cccc(F)c1)C1CCNC1.
What is the InChIKey of 2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide?
The InChIKey is SWCVJZLRGZWXKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-15(2,11-5-4-6-12(16)9-11)14(19)18(3)13-7-8-17-10-13/h4-6,9,13,17H,7-8,10H2,1-3H3.
What are the key properties of 2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide?
2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide has a molecular weight of 264.34 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N,2-dimethyl-N-pyrrolidin-3-ylpropanamide is sourced from PubChem (CID 119550385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).