N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide

C9H19FN2O2 — CID 155741079

IUPACN-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide
SMILESCCC(=O)NCC(F)COCCNC
InChIInChI=1S/C9H19FN2O2/c1-3-9(13)12-6-8(10)7-14-5-4-11-2/h8,11H,3-7H2,1-2H3,(H,12,13)
InChIKeyRCEPEQUYEYCJRN-UHFFFAOYSA-N
MW206.26 g/mol
LogP0.09
Rot. Bonds8

About N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide

N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide (PubChem CID 155741079) has the molecular formula C9H19FN2O2 and a molecular weight of 206.26 g/mol. Its IUPAC name is N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide.

Molecular Properties

Compound NameN-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide
PubChem CID155741079
Molecular FormulaC9H19FN2O2
Molecular Weight206.26 g/mol
Exact Mass206.14
IUPAC NameN-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide
SMILESCCC(=O)NCC(F)COCCNC
InChIInChI=1S/C9H19FN2O2/c1-3-9(13)12-6-8(10)7-14-5-4-11-2/h8,11H,3-7H2,1-2H3,(H,12,13)
InChIKeyRCEPEQUYEYCJRN-UHFFFAOYSA-N
XLogP0.09
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.26
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2-acetamidoethoxy)propyl-trimethyl-azanium Chloride
CID 178377
1-Oxa-4,8-diazacycloundecan-5-one
CID 110201627
2-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]propanamide
CID 60730648
N-[1-[2-[(2-fluoroacetyl)amino]propoxy]propan-2-yl]carbamoyl fluoride
CID 131979484
3-fluoro-N-[2-(2-propoxyethoxy)ethyl]propanamide
CID 135199615
N-[2-fluoro-3-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]propyl]-2-methylpropanamide
CID 138726925
N-[2-fluoro-3-[2-[2-[2-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2-methylpropanamide
CID 138727027
N-[2-fluoro-3-[2-(propan-2-ylamino)ethoxy]butyl]acetamide
CID 138727067
N-[3-[2-[2-[2-(ethylamino)ethoxy]ethoxy]ethoxy]-2-fluoropropyl]-2-methylpropanamide
CID 138727241
N-[2-fluoro-3-methyl-3-[2-[2-(methylamino)ethoxy]ethoxy]butyl]-2-methylpropanamide
CID 138727262
N-[2-fluoro-3-[2-[2-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]-2-methylpropanamide
CID 138727778
N-[3-[2-[2-[2-[2-[(2-ethoxyacetyl)amino]ethoxy]ethoxy]ethoxy]ethoxy]-2-fluoropropyl]propanamide
CID 138727787

Frequently Asked Questions

What is the IUPAC name of N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide?
The IUPAC name of N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide (CID 155741079) is N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide.
What is the SMILES notation for N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide?
The canonical SMILES for N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide is CCC(=O)NCC(F)COCCNC.
What is the InChIKey of N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide?
The InChIKey is RCEPEQUYEYCJRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19FN2O2/c1-3-9(13)12-6-8(10)7-14-5-4-11-2/h8,11H,3-7H2,1-2H3,(H,12,13).
What are the key properties of N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide?
N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide has a molecular weight of 206.26 g/mol, XLogP of 0.09, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-fluoro-3-[2-(methylamino)ethoxy]propyl]propanamide is sourced from PubChem (CID 155741079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).