N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine

C15H23NO — CID 103556215

IUPACN-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine
SMILESCCNC(CC1(OC)CCC1)c1ccccc1
InChIInChI=1S/C15H23NO/c1-3-16-14(13-8-5-4-6-9-13)12-15(17-2)10-7-11-15/h4-6,8-9,14,16H,3,7,10-12H2,1-2H3
InChIKeyRVKVHAXBEWBWKL-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.30
Rot. Bonds6

About N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine

N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine (PubChem CID 103556215) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine.

Molecular Properties

Compound NameN-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine
PubChem CID103556215
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC NameN-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine
SMILESCCNC(CC1(OC)CCC1)c1ccccc1
InChIInChI=1S/C15H23NO/c1-3-16-14(13-8-5-4-6-9-13)12-15(17-2)10-7-11-15/h4-6,8-9,14,16H,3,7,10-12H2,1-2H3
InChIKeyRVKVHAXBEWBWKL-UHFFFAOYSA-N
XLogP3.30
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine?
The IUPAC name of N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine (CID 103556215) is N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine.
What is the SMILES notation for N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine?
The canonical SMILES for N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine is CCNC(CC1(OC)CCC1)c1ccccc1.
What is the InChIKey of N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine?
The InChIKey is RVKVHAXBEWBWKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-3-16-14(13-8-5-4-6-9-13)12-15(17-2)10-7-11-15/h4-6,8-9,14,16H,3,7,10-12H2,1-2H3.
What are the key properties of N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine?
N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine has a molecular weight of 233.36 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(1-methoxycyclobutyl)-1-phenylethanamine is sourced from PubChem (CID 103556215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).