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

C15H22ClNO — CID 103559092

IUPAC1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine
SMILESCCNC(CC1(OC)CCC1)c1cccc(Cl)c1
InChIInChI=1S/C15H22ClNO/c1-3-17-14(11-15(18-2)8-5-9-15)12-6-4-7-13(16)10-12/h4,6-7,10,14,17H,3,5,8-9,11H2,1-2H3
InChIKeyPUATVVMIKZWPSS-UHFFFAOYSA-N
MW267.80 g/mol
LogP3.95
Rot. Bonds6

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

1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine (PubChem CID 103559092) has the molecular formula C15H22ClNO and a molecular weight of 267.80 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine.

Molecular Properties

Compound Name1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine
PubChem CID103559092
Molecular FormulaC15H22ClNO
Molecular Weight267.80 g/mol
Exact Mass267.14
IUPAC Name1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine
SMILESCCNC(CC1(OC)CCC1)c1cccc(Cl)c1
InChIInChI=1S/C15H22ClNO/c1-3-17-14(11-15(18-2)8-5-9-15)12-6-4-7-13(16)10-12/h4,6-7,10,14,17H,3,5,8-9,11H2,1-2H3
InChIKeyPUATVVMIKZWPSS-UHFFFAOYSA-N
XLogP3.95
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 ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-chlorophenyl)-2-(1-methoxycyclobutyl)-N-methylethanamine
CID 103559094
N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine
CID 103556215
N-ethyl-2-(1-methoxycyclobutyl)-1-(3-propan-2-yloxyphenyl)ethanamine
CID 103559672
1-(4-chloro-3-methoxyphenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine
CID 103559564
N-[2-(1-methoxycyclobutyl)-1-(3-methylphenyl)ethyl]propan-1-amine
CID 103559035
N-ethyl-1-(4-ethylphenyl)-2-(1-methoxycyclobutyl)ethanamine
CID 103556238
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-bromo-4-ethoxyphenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine
CID 103556510
N-[1-(3-chloro-4-methylphenyl)-2-(1-methoxycyclobutyl)ethyl]propan-1-amine
CID 107561577
5-[1-(ethylamino)-2-(1-methoxycyclobutyl)ethyl]-1,3-dihydroindol-2-one
CID 103556239
1-(3-bromo-5-chloro-2-methoxyphenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine
CID 103556207

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine?
The IUPAC name of 1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine (CID 103559092) is 1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine.
What is the SMILES notation for 1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine?
The canonical SMILES for 1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine is CCNC(CC1(OC)CCC1)c1cccc(Cl)c1.
What is the InChIKey of 1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine?
The InChIKey is PUATVVMIKZWPSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO/c1-3-17-14(11-15(18-2)8-5-9-15)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 1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine?
1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine has a molecular weight of 267.80 g/mol, XLogP of 3.95, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-N-ethyl-2-(1-methoxycyclobutyl)ethanamine is sourced from PubChem (CID 103559092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).