1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine

C10H19NO2 — CID 102653078

IUPAC1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine
SMILESCOC(C)CCC(N)C1=CCCO1
InChIInChI=1S/C10H19NO2/c1-8(12-2)5-6-9(11)10-4-3-7-13-10/h4,8-9H,3,5-7,11H2,1-2H3
InChIKeyWZOZUGUEQDCTMN-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.43
Rot. Bonds5

About 1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine

1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine (PubChem CID 102653078) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine.

Molecular Properties

Compound Name1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine
PubChem CID102653078
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine
SMILESCOC(C)CCC(N)C1=CCCO1
InChIInChI=1S/C10H19NO2/c1-8(12-2)5-6-9(11)10-4-3-7-13-10/h4,8-9H,3,5-7,11H2,1-2H3
InChIKeyWZOZUGUEQDCTMN-UHFFFAOYSA-N
XLogP1.43
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine?
The IUPAC name of 1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine (CID 102653078) is 1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine.
What is the SMILES notation for 1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine?
The canonical SMILES for 1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine is COC(C)CCC(N)C1=CCCO1.
What is the InChIKey of 1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine?
The InChIKey is WZOZUGUEQDCTMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-8(12-2)5-6-9(11)10-4-3-7-13-10/h4,8-9H,3,5-7,11H2,1-2H3.
What are the key properties of 1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine?
1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine has a molecular weight of 185.27 g/mol, XLogP of 1.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydrofuran-5-yl)-4-methoxypentan-1-amine is sourced from PubChem (CID 102653078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).