1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine

C9H16N2S — CID 105441380

IUPAC1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine
SMILESCC(c1ccc(CN)s1)N(C)C
InChIInChI=1S/C9H16N2S/c1-7(11(2)3)9-5-4-8(6-10)12-9/h4-5,7H,6,10H2,1-3H3
InChIKeyWUUCEHFZFKDKKM-UHFFFAOYSA-N
MW184.31 g/mol
LogP1.83
Rot. Bonds3

About 1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine

1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine (PubChem CID 105441380) has the molecular formula C9H16N2S and a molecular weight of 184.31 g/mol. Its IUPAC name is 1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine.

Molecular Properties

Compound Name1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine
PubChem CID105441380
Molecular FormulaC9H16N2S
Molecular Weight184.31 g/mol
Exact Mass184.10
IUPAC Name1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine
SMILESCC(c1ccc(CN)s1)N(C)C
InChIInChI=1S/C9H16N2S/c1-7(11(2)3)9-5-4-8(6-10)12-9/h4-5,7H,6,10H2,1-3H3
InChIKeyWUUCEHFZFKDKKM-UHFFFAOYSA-N
XLogP1.83
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.31
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-butan-2-ylthiophen-2-yl)methanamine
CID 83827152
1-[5-(aminomethyl)thiophen-2-yl]propan-1-ol
CID 82375071
[5-[(1S)-1-(dimethylamino)ethyl]thiophen-2-yl]boronic acid
CID 129415930
(S)-[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol
CID 97102871
[5-(aminomethyl)thiophen-2-yl]-(furan-3-yl)methanol
CID 71778094
1-[5-(aminomethyl)furan-2-yl]-N,N-dimethylethanamine
CID 105433888
N-[[5-(aminomethyl)thiophen-2-yl]methyl]-1-methoxy-N-methylpropan-2-amine
CID 107556230
N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-methyl-2-propan-2-yloxyethanamine
CID 107557246
5-(aminomethyl)-N-(3,3-dimethylbutan-2-yl)-N-methylthiophene-2-sulfonamide
CID 55009501
[[amino(methyl)amino]-methylamino]-(5-ethylthiophen-2-yl)methanamine
CID 142831502
[5-(2-propan-2-yloxyethoxymethyl)thiophen-2-yl]methanamine
CID 107558122
N-[[5-(aminomethyl)thiophen-2-yl]methyl]-N-methylcyclohexanamine
CID 107555614

Frequently Asked Questions

What is the IUPAC name of 1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine?
The IUPAC name of 1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine (CID 105441380) is 1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine.
What is the SMILES notation for 1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine?
The canonical SMILES for 1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine is CC(c1ccc(CN)s1)N(C)C.
What is the InChIKey of 1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine?
The InChIKey is WUUCEHFZFKDKKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2S/c1-7(11(2)3)9-5-4-8(6-10)12-9/h4-5,7H,6,10H2,1-3H3.
What are the key properties of 1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine?
1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine has a molecular weight of 184.31 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(aminomethyl)thiophen-2-yl]-N,N-dimethylethanamine is sourced from PubChem (CID 105441380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).