3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide

C14H19FN2O — CID 115271910

IUPAC3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide
SMILESO=C(CCc1ccccc1F)NCC1CCNC1
InChIInChI=1S/C14H19FN2O/c15-13-4-2-1-3-12(13)5-6-14(18)17-10-11-7-8-16-9-11/h1-4,11,16H,5-10H2,(H,17,18)
InChIKeyKFLJCXVBYOPASE-UHFFFAOYSA-N
MW250.32 g/mol
LogP1.48
Rot. Bonds5

About 3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide

3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide (PubChem CID 115271910) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide
PubChem CID115271910
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC Name3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide
SMILESO=C(CCc1ccccc1F)NCC1CCNC1
InChIInChI=1S/C14H19FN2O/c15-13-4-2-1-3-12(13)5-6-14(18)17-10-11-7-8-16-9-11/h1-4,11,16H,5-10H2,(H,17,18)
InChIKeyKFLJCXVBYOPASE-UHFFFAOYSA-N
XLogP1.48
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(cyclohexylmethyl)-3-(2-fluorophenyl)propanamide
CID 95899940
3-(4-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide;hydrochloride
CID 91660400
N-[2-(2-fluorophenyl)ethyl]-3-piperidin-4-ylpropanamide
CID 62211196
N-[(2-fluorophenyl)methyl]-1-pyrrolidin-3-ylmethanamine
CID 115208851
N-[(1-cyclopropyl-5-oxopyrrolidin-3-yl)methyl]-3-(2-fluorophenyl)propanamide
CID 110719906
3-(2-fluorophenyl)sulfanyl-N-(piperidin-3-ylmethyl)propanamide
CID 119462366
3-phenoxy-N-(pyrrolidin-3-ylmethyl)propanamide
CID 80564423
3-(3-methylphenyl)-N-(pyrrolidin-3-ylmethyl)propanamide
CID 80563288
3-(2-fluorophenyl)-N-[(1-oxo-3,4-dihydro-2H-isoquinolin-4-yl)methyl]propanamide
CID 110723272
2-fluoro-N-(pyrrolidin-3-ylmethyl)acetamide
CID 174605600
2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride
CID 166436266
1-(2-hydroxyphenyl)-3-(pyrrolidin-3-ylmethyl)urea
CID 117235769

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide?
The IUPAC name of 3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide (CID 115271910) is 3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide.
What is the SMILES notation for 3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide?
The canonical SMILES for 3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide is O=C(CCc1ccccc1F)NCC1CCNC1.
What is the InChIKey of 3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide?
The InChIKey is KFLJCXVBYOPASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c15-13-4-2-1-3-12(13)5-6-14(18)17-10-11-7-8-16-9-11/h1-4,11,16H,5-10H2,(H,17,18).
What are the key properties of 3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide?
3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide has a molecular weight of 250.32 g/mol, XLogP of 1.48, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N-(pyrrolidin-3-ylmethyl)propanamide is sourced from PubChem (CID 115271910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).