1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine

C13H21NO2 — CID 103169378

IUPAC1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine
SMILESCCOC1CC(CC(N)Cc2ccco2)C1
InChIInChI=1S/C13H21NO2/c1-2-15-13-7-10(8-13)6-11(14)9-12-4-3-5-16-12/h3-5,10-11,13H,2,6-9,14H2,1H3
InChIKeyFYXYTAKOSVIGIX-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.35
Rot. Bonds6

About 1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine

1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine (PubChem CID 103169378) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine
PubChem CID103169378
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine
SMILESCCOC1CC(CC(N)Cc2ccco2)C1
InChIInChI=1S/C13H21NO2/c1-2-15-13-7-10(8-13)6-11(14)9-12-4-3-5-16-12/h3-5,10-11,13H,2,6-9,14H2,1H3
InChIKeyFYXYTAKOSVIGIX-UHFFFAOYSA-N
XLogP2.35
TPSA48.39 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 ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-3-(furan-2-yl)propan-2-amine
CID 105029465
1-(3-ethoxycyclobutyl)-3-(4-fluorophenyl)propan-2-amine
CID 103164107
1-(2-chloro-3-fluorophenyl)-3-(3-ethoxycyclobutyl)propan-2-amine
CID 103169422
5-ethoxy-1-(furan-2-yl)pentan-2-amine
CID 105177455
3-ethoxy-N-[1-(furan-2-yl)propan-2-yl]cyclobutan-1-amine
CID 112553035
1-(2,4-dichlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-amine
CID 103168436
1-(2-bromo-5-methoxyphenyl)-3-(3-ethoxycyclobutyl)propan-2-amine
CID 103168715
ethyl 2-amino-3-(furan-2-yl)propanoate
CID 22608494
1-(3-ethoxycyclobutyl)-3-(3-fluoro-4-methoxyphenyl)propan-2-amine
CID 103168394
1-(furan-2-yl)pent-4-en-2-amine
CID 116660416
1,4-bis(furan-2-yl)butan-2-amine
CID 105177346
(3S)-3-amino-4-(furan-2-yl)butanoic acid
CID 2761693

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine?
The IUPAC name of 1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine (CID 103169378) is 1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine.
What is the SMILES notation for 1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine?
The canonical SMILES for 1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine is CCOC1CC(CC(N)Cc2ccco2)C1.
What is the InChIKey of 1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine?
The InChIKey is FYXYTAKOSVIGIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-2-15-13-7-10(8-13)6-11(14)9-12-4-3-5-16-12/h3-5,10-11,13H,2,6-9,14H2,1H3.
What are the key properties of 1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine?
1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine has a molecular weight of 223.32 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxycyclobutyl)-3-(furan-2-yl)propan-2-amine is sourced from PubChem (CID 103169378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).