1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine

C17H20N2O — CID 94074131

IUPAC1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine
SMILESCCCn1cc(CNCc2ccco2)c2ccccc21
InChIInChI=1S/C17H20N2O/c1-2-9-19-13-14(16-7-3-4-8-17(16)19)11-18-12-15-6-5-10-20-15/h3-8,10,13,18H,2,9,11-12H2,1H3
InChIKeySBZYOZKCVXFVTL-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.93
Rot. Bonds6

About 1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine

1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine (PubChem CID 94074131) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine
PubChem CID94074131
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine
SMILESCCCn1cc(CNCc2ccco2)c2ccccc21
InChIInChI=1S/C17H20N2O/c1-2-9-19-13-14(16-7-3-4-8-17(16)19)11-18-12-15-6-5-10-20-15/h3-8,10,13,18H,2,9,11-12H2,1H3
InChIKeySBZYOZKCVXFVTL-UHFFFAOYSA-N
XLogP3.93
TPSA30.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine 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

N-[(1-benzylindol-3-yl)methyl]-1-(furan-2-yl)methanamine
CID 124818061
N-[[1-[(4-fluorophenyl)methyl]indol-3-yl]methyl]-1-(furan-2-yl)methanamine
CID 124784130
1-(4-fluorophenyl)-N-[(1-propylindol-3-yl)methyl]methanamine
CID 119027513
N-methyl-N'-[(1-propylindol-3-yl)methyl]propane-1,3-diamine
CID 119027572
3-[(1-propylindol-3-yl)methylamino]propan-1-ol
CID 94074142
3-methoxy-N-[(1-propylindol-3-yl)methyl]propan-1-amine
CID 94074135
2-(4-fluorophenyl)-N-[(1-propylindol-3-yl)methyl]ethanamine
CID 124804470
2-[3-(ethylaminomethyl)indol-1-yl]ethanol
CID 66409741
1-(oxolan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine
CID 119027030
N-(furan-2-ylmethyl)-1-naphthalen-1-ylmethanamine
CID 1090542
N-(furan-2-ylmethyl)-2-(4-methylindol-1-yl)ethanamine
CID 62562532
N-[[1-(3,3,3-trifluoropropyl)indol-3-yl]methyl]propan-1-amine
CID 66408210

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine?
The IUPAC name of 1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine (CID 94074131) is 1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine.
What is the SMILES notation for 1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine?
The canonical SMILES for 1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine is CCCn1cc(CNCc2ccco2)c2ccccc21.
What is the InChIKey of 1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine?
The InChIKey is SBZYOZKCVXFVTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-2-9-19-13-14(16-7-3-4-8-17(16)19)11-18-12-15-6-5-10-20-15/h3-8,10,13,18H,2,9,11-12H2,1H3.
What are the key properties of 1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine?
1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine has a molecular weight of 268.36 g/mol, XLogP of 3.93, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine is sourced from PubChem (CID 94074131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).