N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide

C15H20F2N2O2 — CID 79882235

IUPACN-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide
SMILESCCNCc1cc(F)c(OC(C)C(=O)NC2CC2)c(F)c1
InChIInChI=1S/C15H20F2N2O2/c1-3-18-8-10-6-12(16)14(13(17)7-10)21-9(2)15(20)19-11-4-5-11/h6-7,9,11,18H,3-5,8H2,1-2H3,(H,19,20)
InChIKeyJHFFBBNBFNQQBJ-UHFFFAOYSA-N
MW298.33 g/mol
LogP2.12
Rot. Bonds7

About N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide

N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide (PubChem CID 79882235) has the molecular formula C15H20F2N2O2 and a molecular weight of 298.33 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide
PubChem CID79882235
Molecular FormulaC15H20F2N2O2
Molecular Weight298.33 g/mol
Exact Mass298.15
IUPAC NameN-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide
SMILESCCNCc1cc(F)c(OC(C)C(=O)NC2CC2)c(F)c1
InChIInChI=1S/C15H20F2N2O2/c1-3-18-8-10-6-12(16)14(13(17)7-10)21-9(2)15(20)19-11-4-5-11/h6-7,9,11,18H,3-5,8H2,1-2H3,(H,19,20)
InChIKeyJHFFBBNBFNQQBJ-UHFFFAOYSA-N
XLogP2.12
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.33
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-carbamoyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide
CID 79882227
2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide
CID 79891642
N-[(3,5-difluoro-4-propan-2-yloxyphenyl)methyl]ethanamine
CID 79892242
N-cyclopentyl-2-(2,6-difluoro-4-formylphenoxy)propanamide
CID 79884292
N-cyclopropyl-2-[2,4-dichloro-6-(ethylaminomethyl)phenoxy]propanamide
CID 43515770
2-[2,6-difluoro-4-[(2-methylpropylamino)methyl]phenoxy]-N-methylpropanamide
CID 79883879
N-cyclopropyl-2-[2-(ethylaminomethyl)-6-methylphenoxy]propanamide
CID 115952731
N-cyclopropyl-2-[4-(propylaminomethyl)phenoxy]propanamide
CID 43276998
N-(cyclopropylmethyl)-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]acetamide
CID 79882213
ethyl 2-[2,6-difluoro-4-(methylaminomethyl)phenoxy]propanoate
CID 79892083
2-[4-(2-aminopropyl)-2,6-difluorophenoxy]-N-methylpropanamide
CID 79887608
2-[1-(cyclopropylamino)-1-oxopropan-2-yl]oxy-3-fluorobenzoic acid
CID 112612134

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide?
The IUPAC name of N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide (CID 79882235) is N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide?
The canonical SMILES for N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide is CCNCc1cc(F)c(OC(C)C(=O)NC2CC2)c(F)c1.
What is the InChIKey of N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide?
The InChIKey is JHFFBBNBFNQQBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O2/c1-3-18-8-10-6-12(16)14(13(17)7-10)21-9(2)15(20)19-11-4-5-11/h6-7,9,11,18H,3-5,8H2,1-2H3,(H,19,20).
What are the key properties of N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide?
N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide has a molecular weight of 298.33 g/mol, XLogP of 2.12, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(ethylaminomethyl)-2,6-difluorophenoxy]propanamide is sourced from PubChem (CID 79882235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).