3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine

C17H20N2O2 — CID 63000090

IUPAC3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine
SMILESc1coc(COCCCNCc2cccc3[nH]ccc23)c1
InChIInChI=1S/C17H20N2O2/c1-4-14(16-7-9-19-17(16)6-1)12-18-8-3-10-20-13-15-5-2-11-21-15/h1-2,4-7,9,11,18-19H,3,8,10,12-13H2
InChIKeyJDASYKJZYPOAGJ-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.46
Rot. Bonds8

About 3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine

3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine (PubChem CID 63000090) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine
PubChem CID63000090
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine
SMILESc1coc(COCCCNCc2cccc3[nH]ccc23)c1
InChIInChI=1S/C17H20N2O2/c1-4-14(16-7-9-19-17(16)6-1)12-18-8-3-10-20-13-15-5-2-11-21-15/h1-2,4-7,9,11,18-19H,3,8,10,12-13H2
InChIKeyJDASYKJZYPOAGJ-UHFFFAOYSA-N
XLogP3.46
TPSA50.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine
CID 102909348
N-(1H-indol-4-ylmethyl)-3-[(4-methoxyphenyl)methoxy]propan-1-amine
CID 119110696
3-(furan-2-ylmethoxy)-N-(1H-imidazol-2-ylmethyl)propan-1-amine
CID 54976458
3-chloro-2-[[3-(furan-2-ylmethoxy)propylamino]methyl]phenol
CID 78959610
N-(1H-indol-4-ylmethyl)-2-(2-methoxyethoxy)ethanamine
CID 63001392
2-(1H-indol-4-ylmethylamino)ethanol
CID 53269747
3-ethoxy-N-[2-(furan-2-ylmethoxy)ethyl]propan-1-amine
CID 62565573
5-(furan-2-ylmethoxy)-N-propylpentan-1-amine
CID 62445042
3-(furan-2-ylmethoxy)-N-(pyridin-3-ylmethyl)propan-1-amine
CID 28681171
3-(furan-2-ylmethoxy)-N-[(3-methyltriazol-4-yl)methyl]propan-1-amine
CID 115682204
N-(cyclopentylmethyl)-3-(furan-2-ylmethoxy)propan-1-amine
CID 62071034
N-[3-(1H-indol-4-ylmethylamino)propyl]ethanesulfonamide
CID 119110562

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine?
The IUPAC name of 3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine (CID 63000090) is 3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine.
What is the SMILES notation for 3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine?
The canonical SMILES for 3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine is c1coc(COCCCNCc2cccc3[nH]ccc23)c1.
What is the InChIKey of 3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine?
The InChIKey is JDASYKJZYPOAGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-4-14(16-7-9-19-17(16)6-1)12-18-8-3-10-20-13-15-5-2-11-21-15/h1-2,4-7,9,11,18-19H,3,8,10,12-13H2.
What are the key properties of 3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine?
3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine has a molecular weight of 284.36 g/mol, XLogP of 3.46, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine is sourced from PubChem (CID 63000090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).