N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine

C12H19NO2 — CID 115711073

IUPACN-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine
SMILESCOCc1ccc(CNC2CC(C)C2)o1
InChIInChI=1S/C12H19NO2/c1-9-5-10(6-9)13-7-11-3-4-12(15-11)8-14-2/h3-4,9-10,13H,5-8H2,1-2H3
InChIKeyILKJPSCSWDUUKT-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.31
Rot. Bonds5

About N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine

N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine (PubChem CID 115711073) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine.

Molecular Properties

Compound NameN-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine
PubChem CID115711073
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC NameN-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine
SMILESCOCc1ccc(CNC2CC(C)C2)o1
InChIInChI=1S/C12H19NO2/c1-9-5-10(6-9)13-7-11-3-4-12(15-11)8-14-2/h3-4,9-10,13H,5-8H2,1-2H3
InChIKeyILKJPSCSWDUUKT-UHFFFAOYSA-N
XLogP2.31
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-chlorofuran-2-yl)methyl]-3-methylcyclobutan-1-amine
CID 115671447
N-[[5-(methoxymethyl)furan-2-yl]methyl]-1-methylpyrrolidin-3-amine
CID 115710716
3-methyl-N-[(5-nitrofuran-2-yl)methyl]cyclobutan-1-amine
CID 115671696
methyl 5-[[(3-methylcyclobutyl)amino]methyl]furan-3-carboxylate
CID 104586483
methyl 5-[[(3,5-dimethylcyclohexyl)amino]methyl]furan-3-carboxylate
CID 104586345
N-[[5-(butan-2-yloxymethyl)furan-2-yl]methyl]cyclopropanamine
CID 62454835
2-[[5-(methoxymethyl)furan-2-yl]methylamino]ethanol
CID 12655820
N-[[2-(methoxymethyl)-1,3-thiazol-4-yl]methyl]-3-methylcyclobutan-1-amine
CID 115671468
3-methoxy-N-[[5-(methoxymethyl)furan-2-yl]methyl]propan-1-amine
CID 115710392
N-[[5-(methoxymethyl)furan-2-yl]methyl]-3,3-dimethylbutan-2-amine
CID 115710834
N-[[5-[(1R,2S)-2-methylcyclopropyl]furan-2-yl]methyl]cyclopropanamine
CID 30116573
N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylpentan-2-amine
CID 115710576

Frequently Asked Questions

What is the IUPAC name of N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine?
The IUPAC name of N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine (CID 115711073) is N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine.
What is the SMILES notation for N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine?
The canonical SMILES for N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine is COCc1ccc(CNC2CC(C)C2)o1.
What is the InChIKey of N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine?
The InChIKey is ILKJPSCSWDUUKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-9-5-10(6-9)13-7-11-3-4-12(15-11)8-14-2/h3-4,9-10,13H,5-8H2,1-2H3.
What are the key properties of N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine?
N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine has a molecular weight of 209.29 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(methoxymethyl)furan-2-yl]methyl]-3-methylcyclobutan-1-amine is sourced from PubChem (CID 115711073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).