2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide

C18H21FN2O — CID 60616184

IUPAC2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide
SMILESCN(CCc1ccccn1)C(=O)C(C)(C)c1ccccc1F
InChIInChI=1S/C18H21FN2O/c1-18(2,15-9-4-5-10-16(15)19)17(22)21(3)13-11-14-8-6-7-12-20-14/h4-10,12H,11,13H2,1-3H3
InChIKeyPIWYIYIMRPZLCU-UHFFFAOYSA-N
MW300.38 g/mol
LogP3.20
Rot. Bonds5

About 2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide

2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide (PubChem CID 60616184) has the molecular formula C18H21FN2O and a molecular weight of 300.38 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide
PubChem CID60616184
Molecular FormulaC18H21FN2O
Molecular Weight300.38 g/mol
Exact Mass300.16
IUPAC Name2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide
SMILESCN(CCc1ccccn1)C(=O)C(C)(C)c1ccccc1F
InChIInChI=1S/C18H21FN2O/c1-18(2,15-9-4-5-10-16(15)19)17(22)21(3)13-11-14-8-6-7-12-20-14/h4-10,12H,11,13H2,1-3H3
InChIKeyPIWYIYIMRPZLCU-UHFFFAOYSA-N
XLogP3.20
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide?
The IUPAC name of 2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide (CID 60616184) is 2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide?
The canonical SMILES for 2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide is CN(CCc1ccccn1)C(=O)C(C)(C)c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide?
The InChIKey is PIWYIYIMRPZLCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2O/c1-18(2,15-9-4-5-10-16(15)19)17(22)21(3)13-11-14-8-6-7-12-20-14/h4-10,12H,11,13H2,1-3H3.
What are the key properties of 2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide?
2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide has a molecular weight of 300.38 g/mol, XLogP of 3.20, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)propanamide is sourced from PubChem (CID 60616184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).