2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide

C15H21FN2O2 — CID 136575977

IUPAC2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide
SMILESCOC1CNCC1NC(=O)C(C)(C)c1cccc(F)c1
InChIInChI=1S/C15H21FN2O2/c1-15(2,10-5-4-6-11(16)7-10)14(19)18-12-8-17-9-13(12)20-3/h4-7,12-13,17H,8-9H2,1-3H3,(H,18,19)
InChIKeyAFXKJDVTQJOIIQ-UHFFFAOYSA-N
MW280.34 g/mol
LogP1.21
Rot. Bonds4

About 2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide

2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide (PubChem CID 136575977) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide
PubChem CID136575977
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC Name2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide
SMILESCOC1CNCC1NC(=O)C(C)(C)c1cccc(F)c1
InChIInChI=1S/C15H21FN2O2/c1-15(2,10-5-4-6-11(16)7-10)14(19)18-12-8-17-9-13(12)20-3/h4-7,12-13,17H,8-9H2,1-3H3,(H,18,19)
InChIKeyAFXKJDVTQJOIIQ-UHFFFAOYSA-N
XLogP1.21
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide 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

2-fluoro-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide;hydrochloride
CID 136575931
2,2,2-trifluoro-N-[(3S,4R)-4-methoxypyrrolidin-3-yl]acetamide
CID 130816451
2,2,2-trifluoro-N-[(3R,4S)-4-methoxypyrrolidin-3-yl]acetamide
CID 130773345
(2R)-2-(2,6-difluorophenyl)-N-[(3S,4S)-4-methoxypyrrolidin-3-yl]propanamide
CID 99852420
2,6-dichloro-N-[(4S)-4-methoxypyrrolidin-3-yl]benzamide
CID 43594211
1-[(3aS,6aR)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-2-(3-fluorophenyl)-2-methylpropan-1-one
CID 120656354
2,5-difluoro-N-[(4S)-4-methoxypyrrolidin-3-yl]benzenesulfonamide
CID 43597247
N-[(3S,4S)-3-methoxypiperidin-4-yl]-3-(trifluoromethyl)benzamide
CID 54389521
N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-methyl-2-phenylpropanamide
CID 43594425
N-[(4S)-4-methoxypyrrolidin-3-yl]naphthalene-2-carboxamide
CID 43594014
2-(3-chlorophenyl)-N-(4-methoxypyrrolidin-3-yl)acetamide;hydrochloride
CID 136561181
N-[2-(3-fluorophenyl)-2-methylpropyl]azetidine-3-carboxamide
CID 115159147

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide?
The IUPAC name of 2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide (CID 136575977) is 2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide is COC1CNCC1NC(=O)C(C)(C)c1cccc(F)c1.
What is the InChIKey of 2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide?
The InChIKey is AFXKJDVTQJOIIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-15(2,10-5-4-6-11(16)7-10)14(19)18-12-8-17-9-13(12)20-3/h4-7,12-13,17H,8-9H2,1-3H3,(H,18,19).
What are the key properties of 2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide?
2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide has a molecular weight of 280.34 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-(4-methoxypyrrolidin-3-yl)-2-methylpropanamide is sourced from PubChem (CID 136575977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).