[3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol

C10H15NO2S — CID 115248861

IUPAC[3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol
SMILESCN(CC1(CO)COC1)c1cccs1
InChIInChI=1S/C10H15NO2S/c1-11(9-3-2-4-14-9)5-10(6-12)7-13-8-10/h2-4,12H,5-8H2,1H3
InChIKeyPADSRLGWKYJHJP-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.19
Rot. Bonds4

About [3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol

[3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol (PubChem CID 115248861) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is [3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol.

Molecular Properties

Compound Name[3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol
PubChem CID115248861
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name[3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol
SMILESCN(CC1(CO)COC1)c1cccs1
InChIInChI=1S/C10H15NO2S/c1-11(9-3-2-4-14-9)5-10(6-12)7-13-8-10/h2-4,12H,5-8H2,1H3
InChIKeyPADSRLGWKYJHJP-UHFFFAOYSA-N
XLogP1.19
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 3-[[methyl(thiophen-2-yl)amino]methyl]oxetane-3-carboxylate
CID 115248623
[3-(thiophen-2-ylsulfanylmethyl)oxetan-3-yl]methanol
CID 111975961
[3-[[benzyl(methyl)amino]methyl]oxetan-3-yl]methanol
CID 111976476
[3-[[N-methyl-4-(2-methylpropyl)anilino]methyl]oxetan-3-yl]methanol
CID 115248876
[3-[[[(2S,4S)-4-fluoro-1-(thiophen-2-ylmethyl)pyrrolidin-2-yl]methyl-methylamino]methyl]oxetan-3-yl]methanol
CID 128974310
[3-[dimethylamino(thiophen-2-yl)methyl]oxetan-3-yl]methanol
CID 116912949
[methyl(thiophen-2-yl)amino]methanethiol
CID 115227704
[3-[[oxolan-2-ylmethyl(thiophen-2-ylmethyl)amino]methyl]oxetan-3-yl]methanol
CID 111976537
N'-methyl-N'-thiophen-2-ylethane-1,2-diamine
CID 96634753
N'-methyl-N'-thiophen-2-ylbutane-1,4-diamine
CID 115201070
[3-[(2-methoxy-N,3,5-trimethylanilino)methyl]oxetan-3-yl]methanol
CID 115248903
[3-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]oxetan-3-yl]methanol
CID 115249023

Frequently Asked Questions

What is the IUPAC name of [3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol?
The IUPAC name of [3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol (CID 115248861) is [3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol.
What is the SMILES notation for [3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol?
The canonical SMILES for [3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol is CN(CC1(CO)COC1)c1cccs1.
What is the InChIKey of [3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol?
The InChIKey is PADSRLGWKYJHJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-11(9-3-2-4-14-9)5-10(6-12)7-13-8-10/h2-4,12H,5-8H2,1H3.
What are the key properties of [3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol?
[3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol has a molecular weight of 213.30 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[methyl(thiophen-2-yl)amino]methyl]oxetan-3-yl]methanol is sourced from PubChem (CID 115248861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).