N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine

C18H21NO2 — CID 62459443

IUPACN-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine
SMILESc1cc(CNC2CC2)c(COc2ccc3c(c2)CCC3)o1
InChIInChI=1S/C18H21NO2/c1-2-13-4-7-17(10-14(13)3-1)21-12-18-15(8-9-20-18)11-19-16-5-6-16/h4,7-10,16,19H,1-3,5-6,11-12H2
InChIKeyHUGMCIDACZMSIQ-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.60
Rot. Bonds6

About N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine

N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine (PubChem CID 62459443) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine
PubChem CID62459443
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine
SMILESc1cc(CNC2CC2)c(COc2ccc3c(c2)CCC3)o1
InChIInChI=1S/C18H21NO2/c1-2-13-4-7-17(10-14(13)3-1)21-12-18-15(8-9-20-18)11-19-16-5-6-16/h4,7-10,16,19H,1-3,5-6,11-12H2
InChIKeyHUGMCIDACZMSIQ-UHFFFAOYSA-N
XLogP3.60
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[2-[(4-fluorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine
CID 62453268
1-[3-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-2-yl]-N-methylmethanamine
CID 62459453
N-[[2-[(5-chloro-3-pyridinyl)oxymethyl]furan-3-yl]methyl]cyclopropanamine
CID 64602366
N-[[2-(methoxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62444084
N-[[2-(2,3-dihydro-1H-inden-5-yloxy)phenyl]methyl]cyclopropanamine
CID 43283536
N-[3-(2,3-dihydro-1H-inden-5-yloxy)propyl]cyclopropanamine
CID 29015190
N-[[3-[(3-chlorophenoxy)methyl]furan-2-yl]methyl]cyclopropanamine
CID 62459727
N-[[2-[(2,3-dichlorophenoxy)methyl]furan-3-yl]methyl]cyclopropanamine
CID 62449785
N-[2-(2,3-dihydro-1H-inden-5-yloxy)ethyl]cycloheptanamine
CID 63516362
N-[3-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propyl]cyclopropanamine
CID 61398719
N-[[2-(butan-2-yloxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62454822
N-[[2-(oxolan-2-ylmethoxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62444616

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine (CID 62459443) is N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine is c1cc(CNC2CC2)c(COc2ccc3c(c2)CCC3)o1.
What is the InChIKey of N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine?
The InChIKey is HUGMCIDACZMSIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-2-13-4-7-17(10-14(13)3-1)21-12-18-15(8-9-20-18)11-19-16-5-6-16/h4,7-10,16,19H,1-3,5-6,11-12H2.
What are the key properties of N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine?
N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine has a molecular weight of 283.37 g/mol, XLogP of 3.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2,3-dihydro-1H-inden-5-yloxymethyl)furan-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62459443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).