1-ethoxybutan-2-amine;furan-2-ylmethanamine

C11H22N2O2 — CID 145473642

IUPAC1-ethoxybutan-2-amine;furan-2-ylmethanamine
SMILESCCOCC(N)CC.NCc1ccco1
InChIInChI=1S/C6H15NO.C5H7NO/c1-3-6(7)5-8-4-2;6-4-5-2-1-3-7-5/h6H,3-5,7H2,1-2H3;1-3H,4,6H2
InChIKeyGIIOPADFYVDGHW-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.50
Rot. Bonds5

About 1-ethoxybutan-2-amine;furan-2-ylmethanamine

1-ethoxybutan-2-amine;furan-2-ylmethanamine (PubChem CID 145473642) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-ethoxybutan-2-amine;furan-2-ylmethanamine.

Molecular Properties

Compound Name1-ethoxybutan-2-amine;furan-2-ylmethanamine
PubChem CID145473642
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name1-ethoxybutan-2-amine;furan-2-ylmethanamine
SMILESCCOCC(N)CC.NCc1ccco1
InChIInChI=1S/C6H15NO.C5H7NO/c1-3-6(7)5-8-4-2;6-4-5-2-1-3-7-5/h6H,3-5,7H2,1-2H3;1-3H,4,6H2
InChIKeyGIIOPADFYVDGHW-UHFFFAOYSA-N
XLogP1.50
TPSA74.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

furan-2-ylmethanamine;methane
CID 20976999
[1-ethoxy-3-(furan-2-yl)propan-2-yl]hydrazine
CID 105235330
5-ethoxy-1-(furan-2-yl)pentan-2-amine
CID 105177455
1-ethoxy-N-(furan-2-ylmethyl)-3-methylbutan-2-amine
CID 103271155
butane;ethane;2-(ethoxymethyl)furan
CID 143895142
2-(furan-2-ylmethyl)butan-1-amine
CID 13029329
2-(ethylperoxymethyl)furan
CID 175094388
ethyl 2-amino-3-(furan-2-yl)propanoate
CID 22608494
2-(2-ethoxy-1-methoxyethyl)furan
CID 573718
2-(1,2-diethoxyethyl)furan
CID 566398
(1S)-1-(furan-2-yl)propan-1-amine;hydrochloride
CID 11615221
2-(2-ethylbutyl)furan
CID 68844643

Frequently Asked Questions

What is the IUPAC name of 1-ethoxybutan-2-amine;furan-2-ylmethanamine?
The IUPAC name of 1-ethoxybutan-2-amine;furan-2-ylmethanamine (CID 145473642) is 1-ethoxybutan-2-amine;furan-2-ylmethanamine.
What is the SMILES notation for 1-ethoxybutan-2-amine;furan-2-ylmethanamine?
The canonical SMILES for 1-ethoxybutan-2-amine;furan-2-ylmethanamine is CCOCC(N)CC.NCc1ccco1.
What is the InChIKey of 1-ethoxybutan-2-amine;furan-2-ylmethanamine?
The InChIKey is GIIOPADFYVDGHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO.C5H7NO/c1-3-6(7)5-8-4-2;6-4-5-2-1-3-7-5/h6H,3-5,7H2,1-2H3;1-3H,4,6H2.
What are the key properties of 1-ethoxybutan-2-amine;furan-2-ylmethanamine?
1-ethoxybutan-2-amine;furan-2-ylmethanamine has a molecular weight of 214.31 g/mol, XLogP of 1.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxybutan-2-amine;furan-2-ylmethanamine is sourced from PubChem (CID 145473642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).