[5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine

C12H20N2OS — CID 62421915

IUPAC[5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine
SMILESCN(Cc1cccs1)CC1CCC(CN)O1
InChIInChI=1S/C12H20N2OS/c1-14(9-12-3-2-6-16-12)8-11-5-4-10(7-13)15-11/h2-3,6,10-11H,4-5,7-9,13H2,1H3
InChIKeyDNUXBXCGXQZHDM-UHFFFAOYSA-N
MW240.37 g/mol
LogP1.69
Rot. Bonds5

About [5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine

[5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine (PubChem CID 62421915) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is [5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine.

Molecular Properties

Compound Name[5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine
PubChem CID62421915
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC Name[5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine
SMILESCN(Cc1cccs1)CC1CCC(CN)O1
InChIInChI=1S/C12H20N2OS/c1-14(9-12-3-2-6-16-12)8-11-5-4-10(7-13)15-11/h2-3,6,10-11H,4-5,7-9,13H2,1H3
InChIKeyDNUXBXCGXQZHDM-UHFFFAOYSA-N
XLogP1.69
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine with MolForge

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Related Compounds

N-[[5-(aminomethyl)oxolan-2-yl]methyl]-N-(thiophen-2-ylmethyl)cyclopropanamine
CID 55069477
N-[[5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methyl]propan-2-amine
CID 62420415
[5-[[(3-bromophenyl)methyl-methylamino]methyl]oxolan-2-yl]methanamine
CID 62461292
3-[[methyl(thiophen-2-ylmethyl)amino]methyl]cyclobutan-1-amine
CID 115214158
N-cyclopropyl-N'-methyl-N'-(thiophen-2-ylmethyl)ethane-1,2-diamine
CID 60843550
[5-[[(4-methoxyphenyl)methyl-methylamino]methyl]oxolan-2-yl]methanamine
CID 62436799
N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]-N-(thiophen-2-ylmethyl)cyclopropanamine
CID 62411164
N-methyl-2-[[methyl(thiophen-2-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 62616177
N-methyl-1-(4-methylpiperidin-2-yl)-N-(thiophen-2-ylmethyl)methanamine
CID 114421220
N-(chloromethyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 115263126
(2S,5R)-5-(aminomethyl)-N-(1-thiophen-2-ylpropan-2-yl)oxolane-2-carboxamide
CID 120787356
2-ethyl-N'-methyl-N'-(thiophen-2-ylmethyl)propane-1,3-diamine
CID 65228216

Frequently Asked Questions

What is the IUPAC name of [5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine?
The IUPAC name of [5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine (CID 62421915) is [5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine.
What is the SMILES notation for [5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine?
The canonical SMILES for [5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine is CN(Cc1cccs1)CC1CCC(CN)O1.
What is the InChIKey of [5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine?
The InChIKey is DNUXBXCGXQZHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-14(9-12-3-2-6-16-12)8-11-5-4-10(7-13)15-11/h2-3,6,10-11H,4-5,7-9,13H2,1H3.
What are the key properties of [5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine?
[5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine has a molecular weight of 240.37 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[[methyl(thiophen-2-ylmethyl)amino]methyl]oxolan-2-yl]methanamine is sourced from PubChem (CID 62421915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).