N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide

C15H20F2N2O2 — CID 86984158

IUPACN-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide
SMILESCC(C(=O)Nc1cc(F)ccc1F)N1CCOC(C)(C)C1
InChIInChI=1S/C15H20F2N2O2/c1-10(19-6-7-21-15(2,3)9-19)14(20)18-13-8-11(16)4-5-12(13)17/h4-5,8,10H,6-7,9H2,1-3H3,(H,18,20)
InChIKeyNKWOJNPAIVCVMI-UHFFFAOYSA-N
MW298.33 g/mol
LogP2.40
Rot. Bonds3

About N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide

N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide (PubChem CID 86984158) has the molecular formula C15H20F2N2O2 and a molecular weight of 298.33 g/mol. Its IUPAC name is N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide.

Molecular Properties

Compound NameN-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide
PubChem CID86984158
Molecular FormulaC15H20F2N2O2
Molecular Weight298.33 g/mol
Exact Mass298.15
IUPAC NameN-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide
SMILESCC(C(=O)Nc1cc(F)ccc1F)N1CCOC(C)(C)C1
InChIInChI=1S/C15H20F2N2O2/c1-10(19-6-7-21-15(2,3)9-19)14(20)18-13-8-11(16)4-5-12(13)17/h4-5,8,10H,6-7,9H2,1-3H3,(H,18,20)
InChIKeyNKWOJNPAIVCVMI-UHFFFAOYSA-N
XLogP2.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.33
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide?
The IUPAC name of N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide (CID 86984158) is N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide.
What is the SMILES notation for N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide?
The canonical SMILES for N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide is CC(C(=O)Nc1cc(F)ccc1F)N1CCOC(C)(C)C1.
What is the InChIKey of N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide?
The InChIKey is NKWOJNPAIVCVMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O2/c1-10(19-6-7-21-15(2,3)9-19)14(20)18-13-8-11(16)4-5-12(13)17/h4-5,8,10H,6-7,9H2,1-3H3,(H,18,20).
What are the key properties of N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide?
N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide has a molecular weight of 298.33 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluorophenyl)-2-(2,2-dimethylmorpholin-4-yl)propanamide is sourced from PubChem (CID 86984158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).