N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide

C20H23FN2O2 — CID 110361842

IUPACN-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide
SMILESCOc1ccccc1CCC(=O)Nc1cc(N2CCCC2)ccc1F
InChIInChI=1S/C20H23FN2O2/c1-25-19-7-3-2-6-15(19)8-11-20(24)22-18-14-16(9-10-17(18)21)23-12-4-5-13-23/h2-3,6-7,9-10,14H,4-5,8,11-13H2,1H3,(H,22,24)
InChIKeyLYEDFGJHNXKLQM-UHFFFAOYSA-N
MW342.41 g/mol
LogP4.01
Rot. Bonds6

About N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide

N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide (PubChem CID 110361842) has the molecular formula C20H23FN2O2 and a molecular weight of 342.41 g/mol. Its IUPAC name is N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide
PubChem CID110361842
Molecular FormulaC20H23FN2O2
Molecular Weight342.41 g/mol
Exact Mass342.17
IUPAC NameN-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide
SMILESCOc1ccccc1CCC(=O)Nc1cc(N2CCCC2)ccc1F
InChIInChI=1S/C20H23FN2O2/c1-25-19-7-3-2-6-15(19)8-11-20(24)22-18-14-16(9-10-17(18)21)23-12-4-5-13-23/h2-3,6-7,9-10,14H,4-5,8,11-13H2,1H3,(H,22,24)
InChIKeyLYEDFGJHNXKLQM-UHFFFAOYSA-N
XLogP4.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.41
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluoro-5-piperidin-1-ylphenyl)-2-(2-methoxyphenoxy)acetamide
CID 110362257
N-(2-fluoro-5-piperidin-1-ylphenyl)propanamide
CID 110362225
N,3-bis(2-methoxyphenyl)propanamide
CID 17394407
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-2-methylpropanamide
CID 110361779
2-(4-chlorophenyl)-N-(2-methoxy-5-pyrrolidin-1-ylphenyl)acetamide
CID 110362005
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide
CID 110361803
N-(2-fluoro-5-piperidin-1-ylphenyl)-3,4,5-trimethoxybenzamide
CID 110362244
4-(1,3-dioxoisoindol-2-yl)-N-(2-fluoro-5-pyrrolidin-1-ylphenyl)butanamide
CID 110361837
N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-(2-methoxyphenyl)propanamide
CID 55370121
N-(2-methoxy-5-piperidin-1-ylphenyl)pentanamide
CID 110359665
3-(2,5-difluorophenyl)-N-(2-fluoro-4,5-dimethoxyphenyl)propanamide
CID 56782937
N-(2-chloro-4,5-dimethoxyphenyl)-3-(2-methoxyphenyl)propanamide
CID 17461303

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide?
The IUPAC name of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide (CID 110361842) is N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide.
What is the SMILES notation for N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide?
The canonical SMILES for N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide is COc1ccccc1CCC(=O)Nc1cc(N2CCCC2)ccc1F.
What is the InChIKey of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide?
The InChIKey is LYEDFGJHNXKLQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN2O2/c1-25-19-7-3-2-6-15(19)8-11-20(24)22-18-14-16(9-10-17(18)21)23-12-4-5-13-23/h2-3,6-7,9-10,14H,4-5,8,11-13H2,1H3,(H,22,24).
What are the key properties of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide?
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide has a molecular weight of 342.41 g/mol, XLogP of 4.01, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3-(2-methoxyphenyl)propanamide is sourced from PubChem (CID 110361842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).