3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide

C23H23FN2O — CID 45210792

IUPAC3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide
SMILESCN(CCc1ccccn1)C(=O)CC(c1ccccc1)c1ccccc1F
InChIInChI=1S/C23H23FN2O/c1-26(16-14-19-11-7-8-15-25-19)23(27)17-21(18-9-3-2-4-10-18)20-12-5-6-13-22(20)24/h2-13,15,21H,14,16-17H2,1H3
InChIKeyPICMWRSFVMEEKB-UHFFFAOYSA-N
MW362.45 g/mol
LogP4.44
Rot. Bonds7

About 3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide

3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide (PubChem CID 45210792) has the molecular formula C23H23FN2O and a molecular weight of 362.45 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide
PubChem CID45210792
Molecular FormulaC23H23FN2O
Molecular Weight362.45 g/mol
Exact Mass362.18
IUPAC Name3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide
SMILESCN(CCc1ccccn1)C(=O)CC(c1ccccc1)c1ccccc1F
InChIInChI=1S/C23H23FN2O/c1-26(16-14-19-11-7-8-15-25-19)23(27)17-21(18-9-3-2-4-10-18)20-12-5-6-13-22(20)24/h2-13,15,21H,14,16-17H2,1H3
InChIKeyPICMWRSFVMEEKB-UHFFFAOYSA-N
XLogP4.44
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-benzyl-4-[methyl(2-pyridin-2-ylethyl)amino]-4-oxobutanoic acid
CID 19785085
3-amino-N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]-3-phenylpropanamide
CID 119953602
2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoacetic acid
CID 43445021
3-[methyl(2-pyridin-2-ylethyl)amino]-3-phenylpropanoic acid
CID 63069614
2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide
CID 60616184
ethane;N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 143678158
N-methyl-2-pyridin-2-yl-N-(pyridin-2-ylmethyl)ethanamine;oxalic acid
CID 2845946
4-fluoro-N-methyl-N-(2-pyridin-2-ylethyl)benzamide;oxalic acid
CID 90483378
N-methyl-N-(2-pyridin-2-ylethyl)prop-1-en-2-amine
CID 178172839
2-fluoro-6-[methyl(2-pyridin-2-ylethyl)amino]benzoic acid
CID 79522521
3-fluoro-N-methyl-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 115646430
4-amino-N-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]pentanamide
CID 120565270

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide?
The IUPAC name of 3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide (CID 45210792) is 3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide.
What is the SMILES notation for 3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide?
The canonical SMILES for 3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide is CN(CCc1ccccn1)C(=O)CC(c1ccccc1)c1ccccc1F.
What is the InChIKey of 3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide?
The InChIKey is PICMWRSFVMEEKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23FN2O/c1-26(16-14-19-11-7-8-15-25-19)23(27)17-21(18-9-3-2-4-10-18)20-12-5-6-13-22(20)24/h2-13,15,21H,14,16-17H2,1H3.
What are the key properties of 3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide?
3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide has a molecular weight of 362.45 g/mol, XLogP of 4.44, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N-methyl-3-phenyl-N-(2-pyridin-2-ylethyl)propanamide is sourced from PubChem (CID 45210792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).