4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide

C15H21FN2O3 — CID 66249079

IUPAC4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide
SMILESCN(CCOc1cccc(F)c1)C(=O)C1(C)COCC1N
InChIInChI=1S/C15H21FN2O3/c1-15(10-20-9-13(15)17)14(19)18(2)6-7-21-12-5-3-4-11(16)8-12/h3-5,8,13H,6-7,9-10,17H2,1-2H3
InChIKeyFZGYEWCLRMBOGC-UHFFFAOYSA-N
MW296.34 g/mol
LogP1.03
Rot. Bonds5

About 4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide

4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide (PubChem CID 66249079) has the molecular formula C15H21FN2O3 and a molecular weight of 296.34 g/mol. Its IUPAC name is 4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide
PubChem CID66249079
Molecular FormulaC15H21FN2O3
Molecular Weight296.34 g/mol
Exact Mass296.15
IUPAC Name4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide
SMILESCN(CCOc1cccc(F)c1)C(=O)C1(C)COCC1N
InChIInChI=1S/C15H21FN2O3/c1-15(10-20-9-13(15)17)14(19)18(2)6-7-21-12-5-3-4-11(16)8-12/h3-5,8,13H,6-7,9-10,17H2,1-2H3
InChIKeyFZGYEWCLRMBOGC-UHFFFAOYSA-N
XLogP1.03
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.34
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-[2-(4-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide
CID 66248870
1-(aminomethyl)-N-[2-(3-fluorophenoxy)ethyl]-N-methylcyclobutane-1-carboxamide
CID 115448098
4-amino-N-[3-(2-methoxyethoxy)phenyl]-3-methyloxolane-3-carboxamide
CID 66250431
4-amino-N,3-dimethyl-N-(3-phenylpropyl)oxolane-3-carboxamide
CID 66249430
2-(1-aminocyclopentyl)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide
CID 64679568
2-(cyclopropylamino)-N-[2-(3-fluorophenoxy)ethyl]-N-methylacetamide
CID 54872660
N-[2-(3-fluorophenoxy)ethyl]-N-methylfuran-2-carboxamide
CID 61063132
2-(ethylamino)-N-[2-(3-fluorophenoxy)ethyl]-N,2-dimethylpropanamide
CID 62836449
4-chloro-N-[2-(3-fluorophenoxy)ethyl]-N-methylbutanamide
CID 63307611
2-amino-N-[2-(3-fluorophenoxy)ethyl]-N-methylbutanediamide
CID 60946637
2-[2-(3-fluorophenoxy)ethyl-methylamino]propanamide
CID 47286834
4-amino-N-[(3-ethoxyphenyl)methyl]-3-methyloxolane-3-carboxamide
CID 66250428

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide?
The IUPAC name of 4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide (CID 66249079) is 4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide is CN(CCOc1cccc(F)c1)C(=O)C1(C)COCC1N.
What is the InChIKey of 4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide?
The InChIKey is FZGYEWCLRMBOGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O3/c1-15(10-20-9-13(15)17)14(19)18(2)6-7-21-12-5-3-4-11(16)8-12/h3-5,8,13H,6-7,9-10,17H2,1-2H3.
What are the key properties of 4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide?
4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide has a molecular weight of 296.34 g/mol, XLogP of 1.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(3-fluorophenoxy)ethyl]-N,3-dimethyloxolane-3-carboxamide is sourced from PubChem (CID 66249079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).