1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine

C14H23NO2 — CID 113364696

IUPAC1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine
SMILESCc1ccc(C(C)NCCC2CCCCO2)o1
InChIInChI=1S/C14H23NO2/c1-11-6-7-14(17-11)12(2)15-9-8-13-5-3-4-10-16-13/h6-7,12-13,15H,3-5,8-10H2,1-2H3
InChIKeyGPDHOLWIPOVEGY-UHFFFAOYSA-N
MW237.34 g/mol
LogP3.20
Rot. Bonds5

About 1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine

1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine (PubChem CID 113364696) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine.

Molecular Properties

Compound Name1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine
PubChem CID113364696
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine
SMILESCc1ccc(C(C)NCCC2CCCCO2)o1
InChIInChI=1S/C14H23NO2/c1-11-6-7-14(17-11)12(2)15-9-8-13-5-3-4-10-16-13/h6-7,12-13,15H,3-5,8-10H2,1-2H3
InChIKeyGPDHOLWIPOVEGY-UHFFFAOYSA-N
XLogP3.20
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-methylfuran-2-yl)methyl]-2-(oxan-2-yl)ethanamine
CID 103992898
1-(2-bromophenyl)-N-[2-(oxan-2-yl)ethyl]ethanamine
CID 103983659
(1S)-N-[2-(oxolan-2-yl)ethyl]-1-phenylethanamine
CID 65163698
1-(2,5-dimethylphenyl)-N-[2-(oxolan-2-yl)ethyl]ethanamine
CID 54917016
1-(5-chlorothiophen-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine
CID 103983947
1-(5-methylfuran-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
CID 65156495
1-(3,4-difluorophenyl)-N-[2-(oxan-2-yl)ethyl]ethanamine
CID 103983538
N-[2-(oxolan-2-yl)ethyl]-1-pyridin-2-ylethanamine
CID 61039958
1-(5-methylfuran-2-yl)-N-[2-(1-methylpiperidin-4-yl)ethyl]ethanamine
CID 115717489
1-(5-ethylthiophen-2-yl)-N-[2-(oxolan-2-yl)ethyl]ethanamine
CID 61335920
1-[1-(5-methylfuran-2-yl)ethylamino]-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 61040225
N-(cyclobutylmethyl)-1-(5-methylfuran-2-yl)ethanamine
CID 43298426

Frequently Asked Questions

What is the IUPAC name of 1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine?
The IUPAC name of 1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine (CID 113364696) is 1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine.
What is the SMILES notation for 1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine?
The canonical SMILES for 1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine is Cc1ccc(C(C)NCCC2CCCCO2)o1.
What is the InChIKey of 1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine?
The InChIKey is GPDHOLWIPOVEGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-11-6-7-14(17-11)12(2)15-9-8-13-5-3-4-10-16-13/h6-7,12-13,15H,3-5,8-10H2,1-2H3.
What are the key properties of 1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine?
1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine has a molecular weight of 237.34 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methylfuran-2-yl)-N-[2-(oxan-2-yl)ethyl]ethanamine is sourced from PubChem (CID 113364696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).