N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine

C14H23NO2 — CID 65156100

IUPACN-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine
SMILESCCNC(CC1CCCO1)c1ccc(CC)o1
InChIInChI=1S/C14H23NO2/c1-3-11-7-8-14(17-11)13(15-4-2)10-12-6-5-9-16-12/h7-8,12-13,15H,3-6,9-10H2,1-2H3
InChIKeyKCVQFAWNCRUBKT-UHFFFAOYSA-N
MW237.34 g/mol
LogP3.06
Rot. Bonds6

About N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine

N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine (PubChem CID 65156100) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine
PubChem CID65156100
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC NameN-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine
SMILESCCNC(CC1CCCO1)c1ccc(CC)o1
InChIInChI=1S/C14H23NO2/c1-3-11-7-8-14(17-11)13(15-4-2)10-12-6-5-9-16-12/h7-8,12-13,15H,3-6,9-10H2,1-2H3
InChIKeyKCVQFAWNCRUBKT-UHFFFAOYSA-N
XLogP3.06
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(5-methylfuran-2-yl)-2-(oxolan-2-yl)ethanamine
CID 65156443
2-cyclobutyl-N-ethyl-1-(5-ethylfuran-2-yl)ethanamine
CID 115863601
3-cyclohexyl-N-ethyl-1-(5-ethylfuran-2-yl)propan-1-amine
CID 63505703
N-ethyl-1-(5-ethylthiophen-2-yl)-2-(oxolan-2-yl)ethanamine
CID 65156624
1-(4-tert-butylphenyl)-N-ethyl-2-(oxolan-2-yl)ethanamine
CID 62550488
1-(3,4-dimethylphenyl)-N-ethyl-2-(oxolan-2-yl)ethanamine
CID 62550458
1-(2,5-diethylphenyl)-N-ethyl-2-(oxolan-2-yl)ethanamine
CID 65156203
1-(4,5-dibromothiophen-2-yl)-N-ethyl-2-(oxolan-2-yl)ethanamine
CID 80533971
1-(4-cyclopropyloxyphenyl)-N-ethyl-2-(oxolan-2-yl)ethanamine
CID 114519253
N-ethyl-1-(2-ethylpyrazol-3-yl)-2-(oxolan-2-yl)ethanamine
CID 63975733
N-ethyl-2-(oxan-2-yl)-1-(3-propylphenyl)ethanamine
CID 116545086
1-(3-bromo-2,6-difluorophenyl)-N-ethyl-2-(oxolan-2-yl)ethanamine
CID 106942259

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine?
The IUPAC name of N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine (CID 65156100) is N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine.
What is the SMILES notation for N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine?
The canonical SMILES for N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine is CCNC(CC1CCCO1)c1ccc(CC)o1.
What is the InChIKey of N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine?
The InChIKey is KCVQFAWNCRUBKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-3-11-7-8-14(17-11)13(15-4-2)10-12-6-5-9-16-12/h7-8,12-13,15H,3-6,9-10H2,1-2H3.
What are the key properties of N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine?
N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine has a molecular weight of 237.34 g/mol, XLogP of 3.06, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-ethylfuran-2-yl)-2-(oxolan-2-yl)ethanamine is sourced from PubChem (CID 65156100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).