2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide

C15H21FN2O — CID 172892735

IUPAC2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN1CCC(c2ccc(F)cc2)C1
InChIInChI=1S/C15H21FN2O/c1-11(2)17-15(19)10-18-8-7-13(9-18)12-3-5-14(16)6-4-12/h3-6,11,13H,7-10H2,1-2H3,(H,17,19)
InChIKeyYXJKUROPNDIUSH-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.14
Rot. Bonds4

About 2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide

2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide (PubChem CID 172892735) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide
PubChem CID172892735
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN1CCC(c2ccc(F)cc2)C1
InChIInChI=1S/C15H21FN2O/c1-11(2)17-15(19)10-18-8-7-13(9-18)12-3-5-14(16)6-4-12/h3-6,11,13H,7-10H2,1-2H3,(H,17,19)
InChIKeyYXJKUROPNDIUSH-UHFFFAOYSA-N
XLogP2.14
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide 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-[(2R)-3-methylbutan-2-yl]-2-[(3R)-3-phenylpyrrolidin-1-yl]acetamide
CID 95280817
N-[(1R)-1-cyclopropylethyl]-2-[(3R)-3-phenylpyrrolidin-1-yl]acetamide
CID 95321250
N-[(4-fluorophenyl)methyl]-2-[3-(4-methoxyphenyl)pyrrolidin-1-yl]acetamide
CID 136580152
2-[4-(4-fluorophenyl)piperazin-1-yl]-N-propan-2-ylacetamide
CID 1439429
3-[2-(4-fluorophenyl)azetidin-1-yl]-N-propan-2-ylpropanamide
CID 91843072
N-[(3R)-1-[2-[(3R)-3-(4-fluorophenyl)pyrrolidin-1-yl]acetyl]piperidin-3-yl]acetamide
CID 97098448
(3S)-1-[2-[[(1S)-1-(4-fluorophenyl)ethyl]amino]-2-oxoethyl]piperidine-3-carboxylic acid
CID 125147582
2-[(3R)-4-[(4-fluorophenyl)methyl]-5-oxo-3-propan-2-yl-1,4-diazepan-1-yl]-N-propan-2-ylacetamide
CID 95532226
2-[4-(4-fluorophenyl)piperidin-1-yl]-N-prop-2-enylacetamide
CID 16671888
1-[2-[[1-(4-fluorophenyl)-2-methylpropyl]amino]-2-oxoethyl]pyrrolidine-3-carboxylic acid;hydrochloride
CID 119903905
N-(4-fluorophenyl)-2-(3-naphthalen-2-ylpyrrolidin-1-yl)acetamide
CID 70338702
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-[(2R)-2-methylmorpholin-4-yl]acetamide
CID 31502166

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide?
The IUPAC name of 2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide (CID 172892735) is 2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide is CC(C)NC(=O)CN1CCC(c2ccc(F)cc2)C1.
What is the InChIKey of 2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide?
The InChIKey is YXJKUROPNDIUSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-11(2)17-15(19)10-18-8-7-13(9-18)12-3-5-14(16)6-4-12/h3-6,11,13H,7-10H2,1-2H3,(H,17,19).
What are the key properties of 2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide?
2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide has a molecular weight of 264.34 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-fluorophenyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide is sourced from PubChem (CID 172892735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).