N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine

C13H21NO3 — CID 55133858

IUPACN-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine
SMILESCNCc1ccoc1COCC1CCOCC1
InChIInChI=1S/C13H21NO3/c1-14-8-12-4-7-17-13(12)10-16-9-11-2-5-15-6-3-11/h4,7,11,14H,2-3,5-6,8-10H2,1H3
InChIKeyQGWRFIUSZXUHPR-UHFFFAOYSA-N
MW239.31 g/mol
LogP1.94
Rot. Bonds6

About N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine

N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine (PubChem CID 55133858) has the molecular formula C13H21NO3 and a molecular weight of 239.31 g/mol. Its IUPAC name is N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine
PubChem CID55133858
Molecular FormulaC13H21NO3
Molecular Weight239.31 g/mol
Exact Mass239.15
IUPAC NameN-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine
SMILESCNCc1ccoc1COCC1CCOCC1
InChIInChI=1S/C13H21NO3/c1-14-8-12-4-7-17-13(12)10-16-9-11-2-5-15-6-3-11/h4,7,11,14H,2-3,5-6,8-10H2,1H3
InChIKeyQGWRFIUSZXUHPR-UHFFFAOYSA-N
XLogP1.94
TPSA43.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.31
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]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

1-[2-(cyclopentylmethoxymethyl)furan-3-yl]-N-methylmethanamine
CID 66321220
N-[[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methyl]cyclopropanamine
CID 62484757
N-[[2-(cyclopentylmethoxymethyl)furan-3-yl]methyl]propan-2-amine
CID 66323355
N-methyl-1-[2-[(6-methylcyclohex-3-en-1-yl)methoxymethyl]furan-3-yl]methanamine
CID 62455359
N-methyl-1-[2-(oxan-4-ylmethoxymethyl)-1-benzofuran-3-yl]methanamine
CID 62470710
N-methyl-1-[2-(4-methylpentoxymethyl)furan-3-yl]methanamine
CID 62455304
N-methyl-1-[5-methyl-4-(oxan-4-ylmethoxymethyl)thiophen-2-yl]methanamine
CID 80734122
1-[2-(but-2-enoxymethyl)furan-3-yl]-N-methylmethanamine
CID 76943462
1-[2-(3,3-dimethylbutoxymethyl)furan-3-yl]-N-methylmethanamine
CID 66225474
N,N-dimethyl-2-[[3-(methylaminomethyl)furan-2-yl]methoxy]ethanamine
CID 62458407
N-methyl-1-[4-(oxolan-3-ylmethoxymethyl)phenyl]methanamine
CID 62484188
N-methyl-1-[2-(3-methylbut-3-enoxymethyl)furan-3-yl]methanamine
CID 114470811

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine?
The IUPAC name of N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine (CID 55133858) is N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine is CNCc1ccoc1COCC1CCOCC1.
What is the InChIKey of N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine?
The InChIKey is QGWRFIUSZXUHPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO3/c1-14-8-12-4-7-17-13(12)10-16-9-11-2-5-15-6-3-11/h4,7,11,14H,2-3,5-6,8-10H2,1H3.
What are the key properties of N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine?
N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine has a molecular weight of 239.31 g/mol, XLogP of 1.94, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(oxan-4-ylmethoxymethyl)furan-3-yl]methanamine is sourced from PubChem (CID 55133858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).