N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine

C9H17NO — CID 170636174

IUPACN-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine
SMILESCCN(CC)CC1=CCCO1
InChIInChI=1S/C9H17NO/c1-3-10(4-2)8-9-6-5-7-11-9/h6H,3-5,7-8H2,1-2H3
InChIKeyGYMIVJICYIGMSH-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.63
Rot. Bonds4

About N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine

N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine (PubChem CID 170636174) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine.

Molecular Properties

Compound NameN-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine
PubChem CID170636174
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine
SMILESCCN(CC)CC1=CCCO1
InChIInChI=1S/C9H17NO/c1-3-10(4-2)8-9-6-5-7-11-9/h6H,3-5,7-8H2,1-2H3
InChIKeyGYMIVJICYIGMSH-UHFFFAOYSA-N
XLogP1.63
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine?
The IUPAC name of N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine (CID 170636174) is N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine.
What is the SMILES notation for N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine?
The canonical SMILES for N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine is CCN(CC)CC1=CCCO1.
What is the InChIKey of N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine?
The InChIKey is GYMIVJICYIGMSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-3-10(4-2)8-9-6-5-7-11-9/h6H,3-5,7-8H2,1-2H3.
What are the key properties of N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine?
N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine has a molecular weight of 155.24 g/mol, XLogP of 1.63, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydrofuran-5-ylmethyl)-N-ethylethanamine is sourced from PubChem (CID 170636174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).