2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine

C15H24FNO — CID 103984394

IUPAC2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine
SMILESCCOCC(CNC(C)C)Cc1ccccc1F
InChIInChI=1S/C15H24FNO/c1-4-18-11-13(10-17-12(2)3)9-14-7-5-6-8-15(14)16/h5-8,12-13,17H,4,9-11H2,1-3H3
InChIKeyNQPQFYTUICEDCH-UHFFFAOYSA-N
MW253.36 g/mol
LogP3.02
Rot. Bonds8

About 2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine

2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine (PubChem CID 103984394) has the molecular formula C15H24FNO and a molecular weight of 253.36 g/mol. Its IUPAC name is 2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Name2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine
PubChem CID103984394
Molecular FormulaC15H24FNO
Molecular Weight253.36 g/mol
Exact Mass253.18
IUPAC Name2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine
SMILESCCOCC(CNC(C)C)Cc1ccccc1F
InChIInChI=1S/C15H24FNO/c1-4-18-11-13(10-17-12(2)3)9-14-7-5-6-8-15(14)16/h5-8,12-13,17H,4,9-11H2,1-3H3
InChIKeyNQPQFYTUICEDCH-UHFFFAOYSA-N
XLogP3.02
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.36
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(ethoxymethyl)-N-ethyl-3-(2-fluorophenyl)propan-1-amine
CID 103984391
2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propylpropan-1-amine
CID 113361847
2-benzyl-3-ethoxy-N-propan-2-ylpropan-1-amine
CID 113361817
4-ethylsulfonyl-2-[(2-fluorophenyl)methyl]-N-propan-2-ylbutan-1-amine
CID 62514756
2-[(2-fluorophenyl)methyl]-N-propan-2-yl-3-thiophen-3-ylpropan-1-amine
CID 62514400
5-ethoxy-2-[(2-fluorophenyl)methyl]-N-(2-methylpropyl)pentan-1-amine
CID 65181083
2-(methoxymethyl)-3-(2-methylphenyl)-N-propan-2-ylpropan-1-amine
CID 103984383
1-(2-ethylbutyl)-2-fluorobenzene
CID 139973427
2-[(2-bromophenyl)methyl]-5-ethoxy-N-propan-2-ylpentan-1-amine
CID 65180423
2-cyclopropyl-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine
CID 113456667
N-ethyl-2-[(2-fluorophenyl)methyl]-4-(2-methylpropoxy)butan-1-amine
CID 106456726
2-[(2-chloro-3-fluorophenyl)methyl]-N-propan-2-ylpentan-1-amine
CID 112654146

Frequently Asked Questions

What is the IUPAC name of 2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine?
The IUPAC name of 2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine (CID 103984394) is 2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for 2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine?
The canonical SMILES for 2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine is CCOCC(CNC(C)C)Cc1ccccc1F.
What is the InChIKey of 2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine?
The InChIKey is NQPQFYTUICEDCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FNO/c1-4-18-11-13(10-17-12(2)3)9-14-7-5-6-8-15(14)16/h5-8,12-13,17H,4,9-11H2,1-3H3.
What are the key properties of 2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine?
2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine has a molecular weight of 253.36 g/mol, XLogP of 3.02, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethoxymethyl)-3-(2-fluorophenyl)-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 103984394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).