N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine

C8H14N2S — CID 16795633

IUPACN,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine
SMILESCN(C)C(CN)c1ccsc1
InChIInChI=1S/C8H14N2S/c1-10(2)8(5-9)7-3-4-11-6-7/h3-4,6,8H,5,9H2,1-2H3
InChIKeyJLSSIEXZXYNSOE-UHFFFAOYSA-N
MW170.28 g/mol
LogP1.31
Rot. Bonds3

About N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine

N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine (PubChem CID 16795633) has the molecular formula C8H14N2S and a molecular weight of 170.28 g/mol. Its IUPAC name is N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine.

Molecular Properties

Compound NameN,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine
PubChem CID16795633
Molecular FormulaC8H14N2S
Molecular Weight170.28 g/mol
Exact Mass170.09
IUPAC NameN,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine
SMILESCN(C)C(CN)c1ccsc1
InChIInChI=1S/C8H14N2S/c1-10(2)8(5-9)7-3-4-11-6-7/h3-4,6,8H,5,9H2,1-2H3
InChIKeyJLSSIEXZXYNSOE-UHFFFAOYSA-N
XLogP1.31
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.28
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(Pyrrolidin-1-yl)-2-(thiophen-3-yl)ethan-1-amine
CID 16787050
Methyl[1-(thiophen-3-yl)propan-2-yl]amine
CID 61077840
2-(4-Methylpiperidin-1-yl)-2-(thiophen-2-yl)ethan-1-amine
CID 4352910
N,N-Dimethyl-N'-[(3-methyl-2-thienyl)methyl]-1,2-ethanediamine
CID 4720499
Methyl[1-(thiophen-3-yl)propan-2-yl]amine hydrochloride
CID 73994837
2-(Thiophen-3-yl)pyrrolidine
CID 3988672
1-(Thiophen-3-yl)ethan-1-amine
CID 14249915
(2-Amino-2-(thiophen-2-yl)ethyl)dimethylamine
CID 16228092
2-(Thiophen-3-yl)piperazine
CID 16740794
n-((3-Methylthiophen-2-yl)methyl)heptan-2-amine
CID 16259083
[2-Amino-1-(thiophen-3-yl)ethyl]diethylamine
CID 16785048
2-{4H,5H,6H,7H-thieno[3,2-c]pyridin-5-yl}propan-1-amine
CID 16789654

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine?
The IUPAC name of N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine (CID 16795633) is N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine.
What is the SMILES notation for N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine?
The canonical SMILES for N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine is CN(C)C(CN)c1ccsc1.
What is the InChIKey of N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine?
The InChIKey is JLSSIEXZXYNSOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2S/c1-10(2)8(5-9)7-3-4-11-6-7/h3-4,6,8H,5,9H2,1-2H3.
What are the key properties of N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine?
N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine has a molecular weight of 170.28 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-thiophen-3-ylethane-1,2-diamine is sourced from PubChem (CID 16795633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).