3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine

C13H21NS — CID 104859799

IUPAC3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine
SMILESCC1CC(NCC(C)(C)c2cccs2)C1
InChIInChI=1S/C13H21NS/c1-10-7-11(8-10)14-9-13(2,3)12-5-4-6-15-12/h4-6,10-11,14H,7-9H2,1-3H3
InChIKeyZYEUALBAZQVYMU-UHFFFAOYSA-N
MW223.38 g/mol
LogP3.41
Rot. Bonds4

About 3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine

3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine (PubChem CID 104859799) has the molecular formula C13H21NS and a molecular weight of 223.38 g/mol. Its IUPAC name is 3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine
PubChem CID104859799
Molecular FormulaC13H21NS
Molecular Weight223.38 g/mol
Exact Mass223.14
IUPAC Name3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine
SMILESCC1CC(NCC(C)(C)c2cccs2)C1
InChIInChI=1S/C13H21NS/c1-10-7-11(8-10)14-9-13(2,3)12-5-4-6-15-12/h4-6,10-11,14H,7-9H2,1-3H3
InChIKeyZYEUALBAZQVYMU-UHFFFAOYSA-N
XLogP3.41
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.38
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine with MolForge

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Related Compounds

N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine
CID 80526034
1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine
CID 81344411
3-(3-methylphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine
CID 80526459
N-(2-methyl-2-thiophen-2-ylpropyl)spiro[4.5]decan-8-amine
CID 114817785
N-(2-methyl-2-thiophen-2-ylpropyl)-1-oxothian-4-amine
CID 80526167
3-(2-methylpropyl)-N-(2-methyl-2-thiophen-2-ylpropyl)cyclohexan-1-amine
CID 107428609
3,3-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclopentan-1-amine
CID 80706060
4-(2-methylbutan-2-yl)-N-(2-methyl-2-thiophen-2-ylpropyl)cyclohexan-1-amine
CID 80526485
3-methoxy-N-(2-methyl-2-thiophen-2-ylpropyl)cyclohexan-1-amine
CID 80527427
N-(2-methyl-2-thiophen-2-ylpropyl)-1,1-dioxothiolan-3-amine
CID 80526202
2-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)oxolan-3-amine
CID 115338696
N-(2-methyl-2-thiophen-2-ylpropyl)-2-propan-2-yloxan-4-amine
CID 80526351

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine?
The IUPAC name of 3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine (CID 104859799) is 3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine.
What is the SMILES notation for 3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine?
The canonical SMILES for 3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine is CC1CC(NCC(C)(C)c2cccs2)C1.
What is the InChIKey of 3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine?
The InChIKey is ZYEUALBAZQVYMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NS/c1-10-7-11(8-10)14-9-13(2,3)12-5-4-6-15-12/h4-6,10-11,14H,7-9H2,1-3H3.
What are the key properties of 3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine?
3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine has a molecular weight of 223.38 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-methyl-2-thiophen-2-ylpropyl)cyclobutan-1-amine is sourced from PubChem (CID 104859799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).