2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine

C14H20FNO — CID 62383124

IUPAC2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine
SMILESCCNCC(OC1CCC1)c1cccc(F)c1
InChIInChI=1S/C14H20FNO/c1-2-16-10-14(17-13-7-4-8-13)11-5-3-6-12(15)9-11/h3,5-6,9,13-14,16H,2,4,7-8,10H2,1H3
InChIKeyUBQBTUCRGGPZRZ-UHFFFAOYSA-N
MW237.32 g/mol
LogP3.05
Rot. Bonds6

About 2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine

2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine (PubChem CID 62383124) has the molecular formula C14H20FNO and a molecular weight of 237.32 g/mol. Its IUPAC name is 2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine.

Molecular Properties

Compound Name2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine
PubChem CID62383124
Molecular FormulaC14H20FNO
Molecular Weight237.32 g/mol
Exact Mass237.15
IUPAC Name2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine
SMILESCCNCC(OC1CCC1)c1cccc(F)c1
InChIInChI=1S/C14H20FNO/c1-2-16-10-14(17-13-7-4-8-13)11-5-3-6-12(15)9-11/h3,5-6,9,13-14,16H,2,4,7-8,10H2,1H3
InChIKeyUBQBTUCRGGPZRZ-UHFFFAOYSA-N
XLogP3.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.32
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine
CID 62383123
2-cycloheptyloxy-2-(3-fluorophenyl)-N-methylethanamine
CID 62109055
2-cyclohexyloxy-N-ethyl-2-(3-methoxyphenyl)ethanamine
CID 62106648
2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine
CID 106204917
1-fluoro-3-[2-iodo-1-(3-methoxycyclohexyl)oxyethyl]benzene
CID 114774271
2-(2-chlorophenyl)-2-cyclohexyloxy-N-ethylethanamine
CID 62108606
2-[(3-chlorophenyl)methoxy]-N-ethyl-2-(3-fluorophenyl)ethanamine
CID 65124788
N-[2-(3-bromophenyl)-2-cyclobutyloxyethyl]cyclopropanamine
CID 62382196
N-[2-(3-fluorophenyl)-2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopropanamine
CID 62106068
N-[2-(3-fluorophenyl)-2-pentan-2-yloxyethyl]cyclopropanamine
CID 102984848
N-[2-(cyclopentylmethoxy)-2-(3-fluorophenyl)ethyl]cyclopropanamine
CID 66321628
N-[2-cyclopentyloxy-2-(3-methylphenyl)ethyl]-2-methylpropan-2-amine
CID 62108431

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine?
The IUPAC name of 2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine (CID 62383124) is 2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine.
What is the SMILES notation for 2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine?
The canonical SMILES for 2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine is CCNCC(OC1CCC1)c1cccc(F)c1.
What is the InChIKey of 2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine?
The InChIKey is UBQBTUCRGGPZRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO/c1-2-16-10-14(17-13-7-4-8-13)11-5-3-6-12(15)9-11/h3,5-6,9,13-14,16H,2,4,7-8,10H2,1H3.
What are the key properties of 2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine?
2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine has a molecular weight of 237.32 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine is sourced from PubChem (CID 62383124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).