N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine

C10H17NO — CID 114979725

IUPACN-ethyl-1-(5-methylfuran-3-yl)propan-1-amine
SMILESCCNC(CC)c1coc(C)c1
InChIInChI=1S/C10H17NO/c1-4-10(11-5-2)9-6-8(3)12-7-9/h6-7,10-11H,4-5H2,1-3H3
InChIKeyJAULNJHZPHZECJ-UHFFFAOYSA-N
MW167.25 g/mol
LogP2.65
Rot. Bonds4

About N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine

N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine (PubChem CID 114979725) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(5-methylfuran-3-yl)propan-1-amine
PubChem CID114979725
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC NameN-ethyl-1-(5-methylfuran-3-yl)propan-1-amine
SMILESCCNC(CC)c1coc(C)c1
InChIInChI=1S/C10H17NO/c1-4-10(11-5-2)9-6-8(3)12-7-9/h6-7,10-11H,4-5H2,1-3H3
InChIKeyJAULNJHZPHZECJ-UHFFFAOYSA-N
XLogP2.65
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethoxy-N-ethyl-1-(5-methylfuran-3-yl)ethanamine
CID 105008082
N-ethyl-1-(5-methylfuran-3-yl)decan-1-amine
CID 115831656
N-ethyl-1-(5-methylfuran-3-yl)pent-3-yn-1-amine
CID 115819808
N-ethyl-1-(5-methylfuran-3-yl)pent-4-yn-1-amine
CID 115859443
N-ethyl-4-methoxy-1-(5-methylfuran-3-yl)butan-1-amine
CID 105055011
2-(4-tert-butylphenyl)-N-ethyl-1-(5-methylfuran-3-yl)ethanamine
CID 115842885
2-(5-chlorothiophen-2-yl)-N-ethyl-1-(5-methylfuran-3-yl)ethanamine
CID 115841690
N-ethyl-1-(5-methylfuran-3-yl)-2-(1,3-thiazol-5-yl)ethanamine
CID 105030608
N-ethyl-1-(5-methylfuran-3-yl)-2-thiophen-3-ylethanamine
CID 114821235
3-methyl-1-(5-methylfuran-3-yl)-N-propylpentan-1-amine
CID 115846210
2-(2-bromo-5-fluorophenyl)-N-ethyl-1-(5-methylfuran-3-yl)ethanamine
CID 115843751
2-(2-chloro-4-fluorophenyl)-N-ethyl-1-(5-methylfuran-3-yl)ethanamine
CID 115840534

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine?
The IUPAC name of N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine (CID 114979725) is N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine?
The canonical SMILES for N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine is CCNC(CC)c1coc(C)c1.
What is the InChIKey of N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine?
The InChIKey is JAULNJHZPHZECJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-4-10(11-5-2)9-6-8(3)12-7-9/h6-7,10-11H,4-5H2,1-3H3.
What are the key properties of N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine?
N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine has a molecular weight of 167.25 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-methylfuran-3-yl)propan-1-amine is sourced from PubChem (CID 114979725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).