N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide

C14H19FN2O2 — CID 81366720

IUPACN-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide
SMILESCOC1CNC(C(=O)N[C@@H](C)c2cccc(F)c2)C1
InChIInChI=1S/C14H19FN2O2/c1-9(10-4-3-5-11(15)6-10)17-14(18)13-7-12(19-2)8-16-13/h3-6,9,12-13,16H,7-8H2,1-2H3,(H,17,18)/t9-,12?,13?/m0/s1
InChIKeyWWVFFXBZNZWLIW-ALXWSUNGSA-N
MW266.32 g/mol
LogP1.38
Rot. Bonds4

About N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide

N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide (PubChem CID 81366720) has the molecular formula C14H19FN2O2 and a molecular weight of 266.32 g/mol. Its IUPAC name is N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide
PubChem CID81366720
Molecular FormulaC14H19FN2O2
Molecular Weight266.32 g/mol
Exact Mass266.14
IUPAC NameN-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide
SMILESCOC1CNC(C(=O)N[C@@H](C)c2cccc(F)c2)C1
InChIInChI=1S/C14H19FN2O2/c1-9(10-4-3-5-11(15)6-10)17-14(18)13-7-12(19-2)8-16-13/h3-6,9,12-13,16H,7-8H2,1-2H3,(H,17,18)/t9-,12?,13?/m0/s1
InChIKeyWWVFFXBZNZWLIW-ALXWSUNGSA-N
XLogP1.38
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide 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-[(1R)-1-(4-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide
CID 81349681
4-methoxy-N-[(1R)-1-(3-methoxyphenyl)ethyl]pyrrolidine-2-carboxamide
CID 81373074
4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide
CID 61214153
4-methoxy-N-[1-(4-methylphenyl)ethyl]pyrrolidine-2-carboxamide
CID 61213616
N-(3-fluorophenyl)-4-methoxypyrrolidine-2-carboxamide
CID 61214159
N-[1-(furan-2-yl)ethyl]-4-methoxypyrrolidine-2-carboxamide
CID 61213451
4-methoxy-N-[1-(2-methylphenyl)ethyl]pyrrolidine-2-carboxamide
CID 61260072
N-[(1R)-1-(3-fluorophenyl)ethyl]azepane-2-carboxamide
CID 81365964
N-[1-(3-fluorophenyl)ethyl]cyclopropanecarboxamide
CID 60630491
N-[(1S)-1-(3-fluorophenyl)ethyl]-2-methylpiperidine-4-carboxamide
CID 106740405
4-methoxy-N-propan-2-ylpyrrolidine-2-carboxamide
CID 61213428
N-[1-(3-chlorophenyl)propyl]-4-methoxypyrrolidine-2-carboxamide
CID 61214763

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide?
The IUPAC name of N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide (CID 81366720) is N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide.
What is the SMILES notation for N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide?
The canonical SMILES for N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide is COC1CNC(C(=O)N[C@@H](C)c2cccc(F)c2)C1.
What is the InChIKey of N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide?
The InChIKey is WWVFFXBZNZWLIW-ALXWSUNGSA-N. The full InChI is InChI=1S/C14H19FN2O2/c1-9(10-4-3-5-11(15)6-10)17-14(18)13-7-12(19-2)8-16-13/h3-6,9,12-13,16H,7-8H2,1-2H3,(H,17,18)/t9-,12?,13?/m0/s1.
What are the key properties of N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide?
N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide has a molecular weight of 266.32 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide is sourced from PubChem (CID 81366720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).