N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine

C10H17NO2 — CID 43205063

IUPACN-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine
SMILESCOCCCNC(C)c1ccco1
InChIInChI=1S/C10H17NO2/c1-9(10-5-3-8-13-10)11-6-4-7-12-2/h3,5,8-9,11H,4,6-7H2,1-2H3
InChIKeyULGSYAJCCOEFPH-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.97
Rot. Bonds6

About N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine

N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine (PubChem CID 43205063) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine
PubChem CID43205063
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC NameN-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine
SMILESCOCCCNC(C)c1ccco1
InChIInChI=1S/C10H17NO2/c1-9(10-5-3-8-13-10)11-6-4-7-12-2/h3,5,8-9,11H,4,6-7H2,1-2H3
InChIKeyULGSYAJCCOEFPH-UHFFFAOYSA-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-methoxypropylsulfanyl)ethyl]ethanamine
CID 63857447
N'-[1-(furan-2-yl)ethyl]-N-(2-methoxyethyl)ethane-1,2-diamine
CID 62561068
1-(furan-2-yl)-N-[2-(2-methoxyethylsulfanyl)ethyl]ethanamine
CID 62578864
N'-[1-(furan-2-yl)ethyl]propane-1,3-diamine
CID 60889681
3-[[(1R)-1-(furan-2-yl)ethyl]amino]propan-1-ol
CID 28714744
N-[1-(furan-2-yl)ethyl]nonan-1-amine
CID 43535684
N-[(1R)-1-(furan-2-yl)ethyl]octan-1-amine
CID 81403081
N'-ethyl-N-[1-(furan-2-yl)ethyl]-N'-(2-methoxyethyl)ethane-1,2-diamine
CID 62554463
(1S)-1-(furan-2-yl)-N-(2-phenoxyethyl)ethanamine
CID 81400353
4-[[(1S)-1-(furan-2-yl)ethyl]amino]butanenitrile
CID 81401126
(1S)-N-(2-ethoxyethyl)-1-(furan-2-yl)ethanamine
CID 81399975
5-[1-(furan-2-yl)ethylamino]pentanenitrile
CID 60698105

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine?
The IUPAC name of N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine (CID 43205063) is N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine is COCCCNC(C)c1ccco1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine?
The InChIKey is ULGSYAJCCOEFPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c1-9(10-5-3-8-13-10)11-6-4-7-12-2/h3,5,8-9,11H,4,6-7H2,1-2H3.
What are the key properties of N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine?
N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine 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 N-[1-(furan-2-yl)ethyl]-3-methoxypropan-1-amine is sourced from PubChem (CID 43205063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).