2,3-dimethyl-3-thiophen-3-ylbutan-2-amine

C10H17NS — CID 18719736

IUPAC2,3-dimethyl-3-thiophen-3-ylbutan-2-amine
SMILESCC(C)(N)C(C)(C)c1ccsc1
InChIInChI=1S/C10H17NS/c1-9(2,10(3,4)11)8-5-6-12-7-8/h5-7H,11H2,1-4H3
InChIKeyAFZOAJUHSCEUOR-UHFFFAOYSA-N
MW183.32 g/mol
LogP2.76
Rot. Bonds2

About 2,3-dimethyl-3-thiophen-3-ylbutan-2-amine

2,3-dimethyl-3-thiophen-3-ylbutan-2-amine (PubChem CID 18719736) has the molecular formula C10H17NS and a molecular weight of 183.32 g/mol. Its IUPAC name is 2,3-dimethyl-3-thiophen-3-ylbutan-2-amine.

Molecular Properties

Compound Name2,3-dimethyl-3-thiophen-3-ylbutan-2-amine
PubChem CID18719736
Molecular FormulaC10H17NS
Molecular Weight183.32 g/mol
Exact Mass183.11
IUPAC Name2,3-dimethyl-3-thiophen-3-ylbutan-2-amine
SMILESCC(C)(N)C(C)(C)c1ccsc1
InChIInChI=1S/C10H17NS/c1-9(2,10(3,4)11)8-5-6-12-7-8/h5-7H,11H2,1-4H3
InChIKeyAFZOAJUHSCEUOR-UHFFFAOYSA-N
XLogP2.76
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.32
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,3-dimethyl-3-thiophen-3-ylbutan-2-amine 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

(2R)-1,1,1-trifluoro-2-thiophen-3-ylpropan-2-amine
CID 131081620
ethane;2-thiophen-3-ylpropan-2-ol
CID 144659448
3-thiophen-3-ylpentan-3-amine
CID 65099925
2-methyl-2-thiophen-3-ylbutan-1-amine
CID 82412624
4-amino-3,3-dimethyl-2-thiophen-3-ylbutan-2-ol
CID 127003873
1-(3,4-dimethylphenyl)-1-thiophen-3-ylethanamine
CID 65099237
1-cyclopentyl-1-thiophen-3-ylethanamine
CID 171097776
3-(trifluoromethyl)thiophene
CID 2769441
3-tert-butylpyridine;3-tert-butylthiophene
CID 159689171
bis(methylamino)-thiophen-3-ylmethanol
CID 126493654
1-(2-fluorophenyl)-1-thiophen-3-ylethanamine
CID 65099629
3-(5-methylnonan-5-yl)thiophene
CID 142069558

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-3-thiophen-3-ylbutan-2-amine?
The IUPAC name of 2,3-dimethyl-3-thiophen-3-ylbutan-2-amine (CID 18719736) is 2,3-dimethyl-3-thiophen-3-ylbutan-2-amine.
What is the SMILES notation for 2,3-dimethyl-3-thiophen-3-ylbutan-2-amine?
The canonical SMILES for 2,3-dimethyl-3-thiophen-3-ylbutan-2-amine is CC(C)(N)C(C)(C)c1ccsc1.
What is the InChIKey of 2,3-dimethyl-3-thiophen-3-ylbutan-2-amine?
The InChIKey is AFZOAJUHSCEUOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NS/c1-9(2,10(3,4)11)8-5-6-12-7-8/h5-7H,11H2,1-4H3.
What are the key properties of 2,3-dimethyl-3-thiophen-3-ylbutan-2-amine?
2,3-dimethyl-3-thiophen-3-ylbutan-2-amine has a molecular weight of 183.32 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-3-thiophen-3-ylbutan-2-amine is sourced from PubChem (CID 18719736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).