[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine

C10H17NOS — CID 107558171

IUPAC[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine
SMILESCC(C)(C)OCc1ccc(CN)s1
InChIInChI=1S/C10H17NOS/c1-10(2,3)12-7-9-5-4-8(6-11)13-9/h4-5H,6-7,11H2,1-3H3
InChIKeyZCEXVMPSPDWFCL-UHFFFAOYSA-N
MW199.32 g/mol
LogP2.52
Rot. Bonds3

About [5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine

[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine (PubChem CID 107558171) has the molecular formula C10H17NOS and a molecular weight of 199.32 g/mol. Its IUPAC name is [5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine.

Molecular Properties

Compound Name[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine
PubChem CID107558171
Molecular FormulaC10H17NOS
Molecular Weight199.32 g/mol
Exact Mass199.10
IUPAC Name[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine
SMILESCC(C)(C)OCc1ccc(CN)s1
InChIInChI=1S/C10H17NOS/c1-10(2,3)12-7-9-5-4-8(6-11)13-9/h4-5H,6-7,11H2,1-3H3
InChIKeyZCEXVMPSPDWFCL-UHFFFAOYSA-N
XLogP2.52
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.32
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine with MolForge

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Related Compounds

N-methyl-1-[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine
CID 107558169
tert-butyl N-[[5-(aminomethyl)thiophen-2-yl]methyl]carbamate
CID 59708483
[5-(2-propan-2-yloxyethoxymethyl)thiophen-2-yl]methanamine
CID 107558122
[5-(2,2-difluoroethoxymethyl)thiophen-2-yl]methanamine
CID 107559173
N-methyl-1-[5-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]thiophen-2-yl]methanamine
CID 107559237
2-bromo-5-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]thiophene
CID 112588661
[5-[(2-chlorophenyl)methoxymethyl]thiophen-2-yl]methanamine
CID 107558073
2-[(2-methylpropan-2-yl)oxymethyl]pyridin-4-amine
CID 79251673
5-[(2-methylpropan-2-yl)oxymethyl]-1,3-thiazole
CID 59305650
(5-butan-2-ylthiophen-2-yl)methanamine
CID 83827152
[3-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]furan-2-yl]methanamine
CID 112589909
N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine
CID 107557246

Frequently Asked Questions

What is the IUPAC name of [5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine?
The IUPAC name of [5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine (CID 107558171) is [5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine.
What is the SMILES notation for [5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine?
The canonical SMILES for [5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine is CC(C)(C)OCc1ccc(CN)s1.
What is the InChIKey of [5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine?
The InChIKey is ZCEXVMPSPDWFCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NOS/c1-10(2,3)12-7-9-5-4-8(6-11)13-9/h4-5H,6-7,11H2,1-3H3.
What are the key properties of [5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine?
[5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine has a molecular weight of 199.32 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(2-methylpropan-2-yl)oxymethyl]thiophen-2-yl]methanamine is sourced from PubChem (CID 107558171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).