2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine

C13H18FNO — CID 62383123

IUPAC2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine
SMILESCNCC(OC1CCC1)c1cccc(F)c1
InChIInChI=1S/C13H18FNO/c1-15-9-13(16-12-6-3-7-12)10-4-2-5-11(14)8-10/h2,4-5,8,12-13,15H,3,6-7,9H2,1H3
InChIKeyFLLUHKIXIXYKOC-UHFFFAOYSA-N
MW223.29 g/mol
LogP2.66
Rot. Bonds5

About 2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine

2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine (PubChem CID 62383123) has the molecular formula C13H18FNO and a molecular weight of 223.29 g/mol. Its IUPAC name is 2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine.

Molecular Properties

Compound Name2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine
PubChem CID62383123
Molecular FormulaC13H18FNO
Molecular Weight223.29 g/mol
Exact Mass223.14
IUPAC Name2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine
SMILESCNCC(OC1CCC1)c1cccc(F)c1
InChIInChI=1S/C13H18FNO/c1-15-9-13(16-12-6-3-7-12)10-4-2-5-11(14)8-10/h2,4-5,8,12-13,15H,3,6-7,9H2,1H3
InChIKeyFLLUHKIXIXYKOC-UHFFFAOYSA-N
XLogP2.66
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.29
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cycloheptyloxy-2-(3-fluorophenyl)-N-methylethanamine
CID 62109055
2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine
CID 62383124
1-fluoro-3-[2-iodo-1-(3-methoxycyclohexyl)oxyethyl]benzene
CID 114774271
2-butan-2-yloxy-2-(3-fluorophenyl)-N-methylethanamine
CID 62107675
N-[2-(3-fluorophenyl)-2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopropanamine
CID 62106068
N-methyl-2-(oxan-4-yloxy)-2-phenylethanamine
CID 62107330
N-[2-(3-bromophenyl)-2-cyclobutyloxyethyl]cyclopropanamine
CID 62382196
2-(3,4-dimethylcyclohexyl)oxy-N-methyl-2-(3-methylphenyl)ethanamine
CID 64745158
2-(3-fluorophenyl)-2-[(2-fluorophenyl)methoxy]-N-methylethanamine
CID 63933012
N-[2-(cyclopentylmethoxy)-2-(3-fluorophenyl)ethyl]cyclopropanamine
CID 66321628
N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine
CID 62108431
3,3-bis(3-fluorophenyl)-N,2-dimethylpropan-1-amine
CID 22708359

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine?
The IUPAC name of 2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine (CID 62383123) is 2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine.
What is the SMILES notation for 2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine?
The canonical SMILES for 2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine is CNCC(OC1CCC1)c1cccc(F)c1.
What is the InChIKey of 2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine?
The InChIKey is FLLUHKIXIXYKOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO/c1-15-9-13(16-12-6-3-7-12)10-4-2-5-11(14)8-10/h2,4-5,8,12-13,15H,3,6-7,9H2,1H3.
What are the key properties of 2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine?
2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine has a molecular weight of 223.29 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine is sourced from PubChem (CID 62383123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).