2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine

C15H22ClNO — CID 116714621

IUPAC2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine
SMILESCCNC(Cc1cccc(Cl)c1)C1(OC)CCC1
InChIInChI=1S/C15H22ClNO/c1-3-17-14(15(18-2)8-5-9-15)11-12-6-4-7-13(16)10-12/h4,6-7,10,14,17H,3,5,8-9,11H2,1-2H3
InChIKeyBDCRZLBRZQVFCJ-UHFFFAOYSA-N
MW267.80 g/mol
LogP3.43
Rot. Bonds6

About 2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine

2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine (PubChem CID 116714621) has the molecular formula C15H22ClNO and a molecular weight of 267.80 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine
PubChem CID116714621
Molecular FormulaC15H22ClNO
Molecular Weight267.80 g/mol
Exact Mass267.14
IUPAC Name2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine
SMILESCCNC(Cc1cccc(Cl)c1)C1(OC)CCC1
InChIInChI=1S/C15H22ClNO/c1-3-17-14(15(18-2)8-5-9-15)11-12-6-4-7-13(16)10-12/h4,6-7,10,14,17H,3,5,8-9,11H2,1-2H3
InChIKeyBDCRZLBRZQVFCJ-UHFFFAOYSA-N
XLogP3.43
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.80
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)-N-ethyl-1-(4-methoxyoxan-4-yl)ethanamine
CID 116765000
2-(3-chlorophenyl)-1-(1-ethoxycyclohexyl)-N-ethylethanamine
CID 116764102
N-[2-(3-chlorophenyl)-1-(1-methoxycyclohexyl)ethyl]propan-1-amine
CID 116763420
2-(3-bromophenyl)-N-ethyl-1-(1-methoxycyclopentyl)ethanamine
CID 104611298
2-(3-chlorophenyl)-1-(4-ethoxyoxan-4-yl)-N-ethylethanamine
CID 116765885
N-[2-(3-chlorophenyl)-1-(4-methoxyoxan-4-yl)ethyl]propan-1-amine
CID 116765198
2-(5-chloro-2-fluorophenyl)-N-ethyl-1-(1-methoxycyclohexyl)ethanamine
CID 103049169
2-(4-chloro-2-fluorophenyl)-N-ethyl-1-(1-methoxycyclopentyl)ethanamine
CID 114856992
[2-(3-chlorophenyl)-1-(1-methoxy-4,4-dimethylcyclohexyl)ethyl]hydrazine
CID 105278104
[2-(3-chlorophenyl)-1-(1-ethoxycyclopentyl)ethyl]hydrazine
CID 105275871
2-(2-chloro-3-fluorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine
CID 116714589
N-[1-(1-methoxycyclobutyl)-2-(3-methoxyphenyl)ethyl]propan-1-amine
CID 116714829

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine?
The IUPAC name of 2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine (CID 116714621) is 2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine.
What is the SMILES notation for 2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine?
The canonical SMILES for 2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine is CCNC(Cc1cccc(Cl)c1)C1(OC)CCC1.
What is the InChIKey of 2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine?
The InChIKey is BDCRZLBRZQVFCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO/c1-3-17-14(15(18-2)8-5-9-15)11-12-6-4-7-13(16)10-12/h4,6-7,10,14,17H,3,5,8-9,11H2,1-2H3.
What are the key properties of 2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine?
2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine has a molecular weight of 267.80 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-ethyl-1-(1-methoxycyclobutyl)ethanamine is sourced from PubChem (CID 116714621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).