3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide

C14H19FN2O — CID 110737633

IUPAC3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide
SMILESCN1CCC(NC(=O)CCc2cccc(F)c2)C1
InChIInChI=1S/C14H19FN2O/c1-17-8-7-13(10-17)16-14(18)6-5-11-3-2-4-12(15)9-11/h2-4,9,13H,5-8,10H2,1H3,(H,16,18)
InChIKeyQEURRQDLDXSIJU-UHFFFAOYSA-N
MW250.32 g/mol
LogP1.58
Rot. Bonds4

About 3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide

3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide (PubChem CID 110737633) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is 3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide.

Molecular Properties

Compound Name3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide
PubChem CID110737633
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC Name3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide
SMILESCN1CCC(NC(=O)CCc2cccc(F)c2)C1
InChIInChI=1S/C14H19FN2O/c1-17-8-7-13(10-17)16-14(18)6-5-11-3-2-4-12(15)9-11/h2-4,9,13H,5-8,10H2,1H3,(H,16,18)
InChIKeyQEURRQDLDXSIJU-UHFFFAOYSA-N
XLogP1.58
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-3-(3-fluorophenyl)propanamide
CID 134047878
3-(3-fluorophenyl)-N-[1-(3-methylbutanoyl)piperidin-4-yl]propanamide
CID 110819641
3-[4-(dimethylamino)phenyl]-N-(1-methylpyrrolidin-3-yl)propanamide
CID 110473838
N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]-3,3-dimethylbutanamide
CID 110822684
N-[1-[3-(3-fluorophenyl)propanoyl]piperidin-4-yl]acetamide
CID 110726946
N-[(3R)-1-benzylpyrrolidin-3-yl]-2-(3-fluorophenyl)acetamide
CID 39959483
3-amino-N-(1-methylpyrrolidin-3-yl)propanamide
CID 61465444
3-(3-methylphenyl)-N-[(3S)-1-(2-morpholin-4-ylethyl)pyrrolidin-3-yl]propanamide
CID 95628573
N-(1-methylpyrrolidin-3-yl)-2-(2-methylsulfanylphenyl)acetamide
CID 110473699
2-(3-fluorophenyl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]acetamide
CID 32541358
N-(1-methylpyrrolidin-3-yl)butanamide
CID 18723360
3-(3-aminophenyl)-N-(1-cyclopropylpiperidin-4-yl)propanamide
CID 115341222

Frequently Asked Questions

What is the IUPAC name of 3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide?
The IUPAC name of 3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide (CID 110737633) is 3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide.
What is the SMILES notation for 3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide?
The canonical SMILES for 3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide is CN1CCC(NC(=O)CCc2cccc(F)c2)C1.
What is the InChIKey of 3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide?
The InChIKey is QEURRQDLDXSIJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c1-17-8-7-13(10-17)16-14(18)6-5-11-3-2-4-12(15)9-11/h2-4,9,13H,5-8,10H2,1H3,(H,16,18).
What are the key properties of 3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide?
3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide has a molecular weight of 250.32 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluorophenyl)-N-(1-methylpyrrolidin-3-yl)propanamide is sourced from PubChem (CID 110737633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).