N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine

C13H21NO2 — CID 103559311

IUPACN-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine
SMILESCCNC(CC1(OC)CCC1)c1ccoc1
InChIInChI=1S/C13H21NO2/c1-3-14-12(11-5-8-16-10-11)9-13(15-2)6-4-7-13/h5,8,10,12,14H,3-4,6-7,9H2,1-2H3
InChIKeyKYYXNZXJRDHUNV-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.89
Rot. Bonds6

About N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine

N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine (PubChem CID 103559311) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine
PubChem CID103559311
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC NameN-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine
SMILESCCNC(CC1(OC)CCC1)c1ccoc1
InChIInChI=1S/C13H21NO2/c1-3-14-12(11-5-8-16-10-11)9-13(15-2)6-4-7-13/h5,8,10,12,14H,3-4,6-7,9H2,1-2H3
InChIKeyKYYXNZXJRDHUNV-UHFFFAOYSA-N
XLogP2.89
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine?
The IUPAC name of N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine (CID 103559311) is N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine.
What is the SMILES notation for N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine?
The canonical SMILES for N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine is CCNC(CC1(OC)CCC1)c1ccoc1.
What is the InChIKey of N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine?
The InChIKey is KYYXNZXJRDHUNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-3-14-12(11-5-8-16-10-11)9-13(15-2)6-4-7-13/h5,8,10,12,14H,3-4,6-7,9H2,1-2H3.
What are the key properties of N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine?
N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine has a molecular weight of 223.32 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(furan-3-yl)-2-(1-methoxycyclobutyl)ethanamine is sourced from PubChem (CID 103559311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).