N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine

C17H27NO — CID 103556238

IUPACN-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine
SMILESCCNC(CC1(OC)CCC1)c1ccc(CC)cc1
InChIInChI=1S/C17H27NO/c1-4-14-7-9-15(10-8-14)16(18-5-2)13-17(19-3)11-6-12-17/h7-10,16,18H,4-6,11-13H2,1-3H3
InChIKeySCXRTQSPRHLEHW-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.86
Rot. Bonds7

About N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine

N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine (PubChem CID 103556238) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine
PubChem CID103556238
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC NameN-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine
SMILESCCNC(CC1(OC)CCC1)c1ccc(CC)cc1
InChIInChI=1S/C17H27NO/c1-4-14-7-9-15(10-8-14)16(18-5-2)13-17(19-3)11-6-12-17/h7-10,16,18H,4-6,11-13H2,1-3H3
InChIKeySCXRTQSPRHLEHW-UHFFFAOYSA-N
XLogP3.86
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine
CID 103556215
N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine
CID 103559311
1-(4-chloro-3-methoxyphenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine
CID 103559564
1-(3-bromo-4-methoxyphenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine
CID 103556204
N-ethyl-1-(3-fluoro-4-methoxyphenyl)-2-(1-methoxycyclobutyl)ethanamine
CID 103556253
1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine
CID 103559092
1-(3-bromo-4-ethoxyphenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine
CID 103556510
N-ethyl-1-(5-ethylthiophen-2-yl)-2-(1-methoxycyclobutyl)ethanamine
CID 103556211
N-[1-(3-ethylphenyl)-2-(1-methoxycyclobutyl)ethyl]propan-1-amine
CID 103559669
N-ethyl-2-(1-methoxycyclobutyl)-1-(3-propan-2-yloxyphenyl)ethanamine
CID 103559672
N-[(4-ethylphenyl)-(1-methoxycyclobutyl)methyl]ethanamine
CID 116714561
5-[1-(ethylamino)-2-(1-methoxycyclobutyl)ethyl]-1,3-dihydroindol-2-one
CID 103556239

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine?
The IUPAC name of N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine (CID 103556238) is N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine.
What is the SMILES notation for N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine?
The canonical SMILES for N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine is CCNC(CC1(OC)CCC1)c1ccc(CC)cc1.
What is the InChIKey of N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine?
The InChIKey is SCXRTQSPRHLEHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c1-4-14-7-9-15(10-8-14)16(18-5-2)13-17(19-3)11-6-12-17/h7-10,16,18H,4-6,11-13H2,1-3H3.
What are the key properties of N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine?
N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine has a molecular weight of 261.41 g/mol, XLogP of 3.86, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine is sourced from PubChem (CID 103556238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).