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

C15H22FNO — CID 106204917

IUPAC2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine
SMILESCCNCC(OCCC1CC1)c1cccc(F)c1
InChIInChI=1S/C15H22FNO/c1-2-17-11-15(18-9-8-12-6-7-12)13-4-3-5-14(16)10-13/h3-5,10,12,15,17H,2,6-9,11H2,1H3
InChIKeyMQZGUNCVJYEOSO-UHFFFAOYSA-N
MW251.34 g/mol
LogP3.29
Rot. Bonds8

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

2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine (PubChem CID 106204917) has the molecular formula C15H22FNO and a molecular weight of 251.34 g/mol. Its IUPAC name is 2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine.

Molecular Properties

Compound Name2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine
PubChem CID106204917
Molecular FormulaC15H22FNO
Molecular Weight251.34 g/mol
Exact Mass251.17
IUPAC Name2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine
SMILESCCNCC(OCCC1CC1)c1cccc(F)c1
InChIInChI=1S/C15H22FNO/c1-2-17-11-15(18-9-8-12-6-7-12)13-4-3-5-14(16)10-13/h3-5,10,12,15,17H,2,6-9,11H2,1H3
InChIKeyMQZGUNCVJYEOSO-UHFFFAOYSA-N
XLogP3.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.34
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-cyclopropylethoxy)-2-(3-fluorophenyl)ethyl]propan-2-amine
CID 106204997
2-(2-cyclopropylethoxy)-N-ethyl-2-phenylethanamine
CID 106204975
2-(2-cyclobutylethoxy)-N-ethyl-2-(3-methoxyphenyl)ethanamine
CID 106205144
2-(2-cyclopropylethoxy)-N-ethyl-2-(2-fluorophenyl)ethanamine
CID 114157889
2-cyclobutyloxy-N-ethyl-2-(3-fluorophenyl)ethanamine
CID 62383124
2-(4-bromophenyl)-2-(2-cyclobutylethoxy)-N-ethylethanamine
CID 106205111
2-[(3-chlorophenyl)methoxy]-N-ethyl-2-(3-fluorophenyl)ethanamine
CID 65124788
2-(cyclopropylmethoxy)-N-ethyl-2-(4-fluorophenyl)ethanamine
CID 55036276
2-(2-chlorophenyl)-2-(2-cyclobutylethoxy)-N-ethylethanamine
CID 106205061
N-[2-(3-fluorophenyl)-2-[(2-methylpropan-2-yl)oxy]ethyl]cyclopropanamine
CID 62106068
N-[2-(3-fluorophenyl)-2-(2-propan-2-yloxyethoxy)ethyl]-2-methylpropan-2-amine
CID 62108475
N-[2-(3-fluorophenyl)-2-hexoxyethyl]-2-methylpropan-2-amine
CID 63475905

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine?
The IUPAC name of 2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine (CID 106204917) is 2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine.
What is the SMILES notation for 2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine?
The canonical SMILES for 2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine is CCNCC(OCCC1CC1)c1cccc(F)c1.
What is the InChIKey of 2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine?
The InChIKey is MQZGUNCVJYEOSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FNO/c1-2-17-11-15(18-9-8-12-6-7-12)13-4-3-5-14(16)10-13/h3-5,10,12,15,17H,2,6-9,11H2,1H3.
What are the key properties of 2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine?
2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine has a molecular weight of 251.34 g/mol, XLogP of 3.29, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopropylethoxy)-N-ethyl-2-(3-fluorophenyl)ethanamine is sourced from PubChem (CID 106204917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).