(1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine

C10H17NO2 — CID 81399975

IUPAC(1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine
SMILESCCOCCN[C@@H](C)c1ccco1
InChIInChI=1S/C10H17NO2/c1-3-12-8-6-11-9(2)10-5-4-7-13-10/h4-5,7,9,11H,3,6,8H2,1-2H3/t9-/m0/s1
InChIKeyOWCMKKBNURJSRV-VIFPVBQESA-N
MW183.25 g/mol
LogP1.97
Rot. Bonds6

About (1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine

(1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine (PubChem CID 81399975) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is (1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine.

Molecular Properties

Compound Name(1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine
PubChem CID81399975
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name(1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine
SMILESCCOCCN[C@@H](C)c1ccco1
InChIInChI=1S/C10H17NO2/c1-3-12-8-6-11-9(2)10-5-4-7-13-10/h4-5,7,9,11H,3,6,8H2,1-2H3/t9-/m0/s1
InChIKeyOWCMKKBNURJSRV-VIFPVBQESA-N
XLogP1.97
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(furan-2-yl)-N-[2-(3-methylbutoxy)ethyl]ethanamine
CID 61483869
N-[2-(cyclopropylmethoxy)ethyl]-1-(furan-2-yl)ethanamine
CID 62598356
1-(furan-2-yl)-N-(2-pentan-2-yloxyethyl)ethanamine
CID 102987416
1-(2-ethoxyethoxy)-3-[1-(furan-2-yl)ethylamino]propan-2-ol
CID 54938711
(1S)-1-(furan-2-yl)-N-(2-phenoxyethyl)ethanamine
CID 81400353
N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine
CID 43205063
1-(furan-2-yl)-N-[2-(2-methoxyethylsulfanyl)ethyl]ethanamine
CID 62578864
N-[(1R)-1-(furan-2-yl)ethyl]octan-1-amine
CID 81403081
N-[1-(furan-2-yl)ethyl]nonan-1-amine
CID 43535684
N'-[1-(furan-2-yl)ethyl]-N-(2-methoxyethyl)ethane-1,2-diamine
CID 62561068
N-(2-ethoxyethyl)-1-(5-methylfuran-2-yl)ethanamine
CID 43403764
2,2-diethoxy-N-[(1S)-1-(furan-2-yl)ethyl]ethanamine
CID 81400852

Frequently Asked Questions

What is the IUPAC name of (1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine?
The IUPAC name of (1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine (CID 81399975) is (1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine.
What is the SMILES notation for (1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine?
The canonical SMILES for (1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine is CCOCCN[C@@H](C)c1ccco1.
What is the InChIKey of (1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine?
The InChIKey is OWCMKKBNURJSRV-VIFPVBQESA-N. The full InChI is InChI=1S/C10H17NO2/c1-3-12-8-6-11-9(2)10-5-4-7-13-10/h4-5,7,9,11H,3,6,8H2,1-2H3/t9-/m0/s1.
What are the key properties of (1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine?
(1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine has a molecular weight of 183.25 g/mol, XLogP of 1.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine is sourced from PubChem (CID 81399975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).