N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine

C15H24FNO — CID 103024868

IUPACN-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine
SMILESCCNC(Cc1ccccc1F)CC(C)(C)OC
InChIInChI=1S/C15H24FNO/c1-5-17-13(11-15(2,3)18-4)10-12-8-6-7-9-14(12)16/h6-9,13,17H,5,10-11H2,1-4H3
InChIKeyLFPIYTRIRPIASB-UHFFFAOYSA-N
MW253.36 g/mol
LogP3.16
Rot. Bonds7

About N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine

N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine (PubChem CID 103024868) has the molecular formula C15H24FNO and a molecular weight of 253.36 g/mol. Its IUPAC name is N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine
PubChem CID103024868
Molecular FormulaC15H24FNO
Molecular Weight253.36 g/mol
Exact Mass253.18
IUPAC NameN-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine
SMILESCCNC(Cc1ccccc1F)CC(C)(C)OC
InChIInChI=1S/C15H24FNO/c1-5-17-13(11-15(2,3)18-4)10-12-8-6-7-9-14(12)16/h6-9,13,17H,5,10-11H2,1-4H3
InChIKeyLFPIYTRIRPIASB-UHFFFAOYSA-N
XLogP3.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.36
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2-fluorophenyl)propan-2-yl]-2-methoxy-2-methylpropan-1-amine
CID 114830797
1-(2-fluorophenyl)-4,4-dimethyl-N-propylpentan-2-amine
CID 61066309
1-(2,4-difluorophenyl)-N-ethyl-3-(2-fluorophenyl)propan-2-amine
CID 62196900
1-(2,4-difluorophenyl)-4-methoxy-4-methyl-N-propylpentan-2-amine
CID 103025007
1-(3-bromo-2,6-difluorophenyl)-N-ethyl-4-methoxy-4-methylpentan-2-amine
CID 106274060
N-ethyl-1-(2-fluorophenyl)undecan-2-amine
CID 63416880
1-(4-chlorophenyl)-N-ethyl-3-(2-fluorophenyl)propan-2-amine
CID 60818141
N-ethyl-1-(2-fluorophenyl)hex-4-yn-2-amine
CID 62310597
1-(4-chloro-2-fluorophenyl)-N-ethyl-3-(2-fluorophenyl)propan-2-amine
CID 114855387
1-(4-bromo-2-chlorophenyl)-N-ethyl-4-methoxy-4-methylpentan-2-amine
CID 103029350
[1-(2-fluorophenyl)-3-methoxy-3-methylbutan-2-yl]hydrazine
CID 105245348
1-(2,3-difluorophenyl)-N-ethyl-3-methoxypropan-2-amine
CID 62604659

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine?
The IUPAC name of N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine (CID 103024868) is N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine.
What is the SMILES notation for N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine?
The canonical SMILES for N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine is CCNC(Cc1ccccc1F)CC(C)(C)OC.
What is the InChIKey of N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine?
The InChIKey is LFPIYTRIRPIASB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24FNO/c1-5-17-13(11-15(2,3)18-4)10-12-8-6-7-9-14(12)16/h6-9,13,17H,5,10-11H2,1-4H3.
What are the key properties of N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine?
N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine has a molecular weight of 253.36 g/mol, XLogP of 3.16, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(2-fluorophenyl)-4-methoxy-4-methylpentan-2-amine is sourced from PubChem (CID 103024868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).