N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine

C18H24N2O — CID 62425759

IUPACN-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1ccc(CN2CCc3ccccc32)o1
InChIInChI=1S/C18H24N2O/c1-18(2,3)19-12-15-8-9-16(21-15)13-20-11-10-14-6-4-5-7-17(14)20/h4-9,19H,10-13H2,1-3H3
InChIKeyRJIGXGJACRUSCB-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.73
Rot. Bonds4

About N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine

N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine (PubChem CID 62425759) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine
PubChem CID62425759
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC NameN-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1ccc(CN2CCc3ccccc32)o1
InChIInChI=1S/C18H24N2O/c1-18(2,3)19-12-15-8-9-16(21-15)13-20-11-10-14-6-4-5-7-17(14)20/h4-9,19H,10-13H2,1-3H3
InChIKeyRJIGXGJACRUSCB-UHFFFAOYSA-N
XLogP3.73
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-(3,4-dihydro-2H-quinolin-1-ylmethyl)furan-2-yl]methyl]propan-1-amine
CID 62425596
1-(furan-2-ylmethyl)-2,3-dihydroindole
CID 14884168
1-(2,3-dihydroindol-1-yl)-N-ethyl-2-methylpropan-2-amine
CID 62834088
3-(2,3-dihydroindol-1-yl)-N-[(5-methylfuran-2-yl)methyl]propan-1-amine
CID 29033925
1-(2,3-dihydroindol-1-yl)-3,3-dimethylbutan-2-amine
CID 16790029
2-methyl-N-[[5-(1,4-thiazepan-4-ylmethyl)furan-2-yl]methyl]propan-2-amine
CID 62411694
1-(2,2-dimethylbutyl)-2,3-dihydroindole
CID 167187652
[4-(2,3-dihydroindol-1-ylmethyl)phenyl]-trimethylsilane
CID 103438257
N-tert-butyl-3-(2,3-dihydroindol-1-yl)-2-methylbutan-1-amine
CID 79414718
N-[[2-(2,3-dihydroindol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62280665
N-[[6-(2,3-dihydroindol-1-yl)-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62280837
1-(2-iodoethyl)-2,3-dihydroindole
CID 131082836

Frequently Asked Questions

What is the IUPAC name of N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine (CID 62425759) is N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine is CC(C)(C)NCc1ccc(CN2CCc3ccccc32)o1.
What is the InChIKey of N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is RJIGXGJACRUSCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-18(2,3)19-12-15-8-9-16(21-15)13-20-11-10-14-6-4-5-7-17(14)20/h4-9,19H,10-13H2,1-3H3.
What are the key properties of N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine?
N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 284.40 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(2,3-dihydroindol-1-ylmethyl)furan-2-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62425759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).