1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine

C10H15NO2S — CID 139987725

IUPAC1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1ccc(C2OCCO2)s1
InChIInChI=1S/C10H15NO2S/c1-11(2)7-8-3-4-9(14-8)10-12-5-6-13-10/h3-4,10H,5-7H2,1-2H3
InChIKeyMRTUBRCQKZRYBJ-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.86
Rot. Bonds3

About 1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine

1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine (PubChem CID 139987725) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is 1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine
PubChem CID139987725
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1ccc(C2OCCO2)s1
InChIInChI=1S/C10H15NO2S/c1-11(2)7-8-3-4-9(14-8)10-12-5-6-13-10/h3-4,10H,5-7H2,1-2H3
InChIKeyMRTUBRCQKZRYBJ-UHFFFAOYSA-N
XLogP1.86
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine (CID 139987725) is 1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine is CN(C)Cc1ccc(C2OCCO2)s1.
What is the InChIKey of 1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine?
The InChIKey is MRTUBRCQKZRYBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-11(2)7-8-3-4-9(14-8)10-12-5-6-13-10/h3-4,10H,5-7H2,1-2H3.
What are the key properties of 1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine?
1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine has a molecular weight of 213.30 g/mol, XLogP of 1.86, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 139987725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).