N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine

C13H21NO2 — CID 62446253

IUPACN-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine
SMILESCC(C)COCc1ccoc1CNC1CC1
InChIInChI=1S/C13H21NO2/c1-10(2)8-15-9-11-5-6-16-13(11)7-14-12-3-4-12/h5-6,10,12,14H,3-4,7-9H2,1-2H3
InChIKeySKNQPIUHIBGDHJ-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.70
Rot. Bonds7

About N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine

N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine (PubChem CID 62446253) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine
PubChem CID62446253
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC NameN-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine
SMILESCC(C)COCc1ccoc1CNC1CC1
InChIInChI=1S/C13H21NO2/c1-10(2)8-15-9-11-5-6-16-13(11)7-14-12-3-4-12/h5-6,10,12,14H,3-4,7-9H2,1-2H3
InChIKeySKNQPIUHIBGDHJ-UHFFFAOYSA-N
XLogP2.70
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[3-(3-methoxypropoxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 62442427
N-[[3-[2-(dimethylamino)ethoxymethyl]furan-2-yl]methyl]cyclopropanamine
CID 62460189
N-[[3-(hexoxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 62455337
N-[[3-(octoxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 62457612
N-[[3-(2-cyclobutylethoxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 106206176
N-[[3-(oxan-4-yloxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 62440336
N-[[3-(pent-4-enoxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 79113810
N-methyl-1-[3-[2-(2-methylpropoxy)ethoxymethyl]furan-2-yl]methanamine
CID 106449861
N-[[3-[(2-ethylcyclohexyl)oxymethyl]furan-2-yl]methyl]cyclopropanamine
CID 62443768
N-[[3-[(3-methoxyphenyl)methoxymethyl]furan-2-yl]methyl]cyclopropanamine
CID 62440737
N-[[2-(methoxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62444084
N-[[2-(butan-2-yloxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62454822

Frequently Asked Questions

What is the IUPAC name of N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine (CID 62446253) is N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine is CC(C)COCc1ccoc1CNC1CC1.
What is the InChIKey of N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine?
The InChIKey is SKNQPIUHIBGDHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-10(2)8-15-9-11-5-6-16-13(11)7-14-12-3-4-12/h5-6,10,12,14H,3-4,7-9H2,1-2H3.
What are the key properties of N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine?
N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine has a molecular weight of 223.32 g/mol, XLogP of 2.70, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(2-methylpropoxymethyl)furan-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62446253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).