3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine

C17H20N2O2 — CID 102909348

IUPAC3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine
SMILESc1coc(COCCCNCc2ccc3[nH]ccc3c2)c1
InChIInChI=1S/C17H20N2O2/c1-3-16(21-10-1)13-20-9-2-7-18-12-14-4-5-17-15(11-14)6-8-19-17/h1,3-6,8,10-11,18-19H,2,7,9,12-13H2
InChIKeyBZPXPHBCJVVPCA-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.46
Rot. Bonds8

About 3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine

3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine (PubChem CID 102909348) 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-5-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine
PubChem CID102909348
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine
SMILESc1coc(COCCCNCc2ccc3[nH]ccc3c2)c1
InChIInChI=1S/C17H20N2O2/c1-3-16(21-10-1)13-20-9-2-7-18-12-14-4-5-17-15(11-14)6-8-19-17/h1,3-6,8,10-11,18-19H,2,7,9,12-13H2
InChIKeyBZPXPHBCJVVPCA-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'}

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Related Compounds

3-(furan-2-ylmethoxy)-N-(1H-indol-4-ylmethyl)propan-1-amine
CID 63000090
3-(furan-2-ylmethoxy)-N-(1H-imidazol-2-ylmethyl)propan-1-amine
CID 54976458
2,6-difluoro-4-[[3-(furan-2-ylmethoxy)propylamino]methyl]phenol
CID 79832671
3-[[3-(furan-2-ylmethoxy)propylamino]methyl]benzamide
CID 60976249
3-(furan-2-ylmethoxy)-N-(pyridin-3-ylmethyl)propan-1-amine
CID 28681171
N-[4-[[3-(furan-2-ylmethoxy)propylamino]methyl]phenyl]acetamide
CID 17451443
N-benzyl-2-(furan-2-ylmethoxy)ethanamine
CID 62564992
N-(cyclopentylmethyl)-3-(furan-2-ylmethoxy)propan-1-amine
CID 62071034
N-(1H-indol-5-ylmethyl)-2-(2-methylpropoxy)ethanamine
CID 102912150
N-[(4-chlorothiophen-2-yl)methyl]-3-(furan-2-ylmethoxy)propan-1-amine
CID 79420297
methyl 5-[[3-(furan-2-ylmethoxy)propylamino]methyl]furan-2-carboxylate
CID 43232167
N-(1H-indol-5-ylmethyl)-2-propan-2-yloxyethanamine
CID 102911874

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine?
The IUPAC name of 3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine (CID 102909348) is 3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine.
What is the SMILES notation for 3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine?
The canonical SMILES for 3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine is c1coc(COCCCNCc2ccc3[nH]ccc3c2)c1.
What is the InChIKey of 3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine?
The InChIKey is BZPXPHBCJVVPCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-3-16(21-10-1)13-20-9-2-7-18-12-14-4-5-17-15(11-14)6-8-19-17/h1,3-6,8,10-11,18-19H,2,7,9,12-13H2.
What are the key properties of 3-(furan-2-ylmethoxy)-N-(1H-indol-5-ylmethyl)propan-1-amine?
3-(furan-2-ylmethoxy)-N-(1H-indol-5-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-5-ylmethyl)propan-1-amine is sourced from PubChem (CID 102909348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).