N-ethyl-N-(thiophen-2-ylmethyl)ethanamine

C9H15NS — CID 69380552

IUPACN-ethyl-N-(thiophen-2-ylmethyl)ethanamine
SMILESCCN(CC)Cc1cccs1
InChIInChI=1S/C9H15NS/c1-3-10(4-2)8-9-6-5-7-11-9/h5-7H,3-4,8H2,1-2H3
InChIKeyZYVYZCLEVCIHAE-UHFFFAOYSA-N
MW169.29 g/mol
LogP2.59
Rot. Bonds4

About N-ethyl-N-(thiophen-2-ylmethyl)ethanamine

N-ethyl-N-(thiophen-2-ylmethyl)ethanamine (PubChem CID 69380552) has the molecular formula C9H15NS and a molecular weight of 169.29 g/mol. Its IUPAC name is N-ethyl-N-(thiophen-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-N-(thiophen-2-ylmethyl)ethanamine
PubChem CID69380552
Molecular FormulaC9H15NS
Molecular Weight169.29 g/mol
Exact Mass169.09
IUPAC NameN-ethyl-N-(thiophen-2-ylmethyl)ethanamine
SMILESCCN(CC)Cc1cccs1
InChIInChI=1S/C9H15NS/c1-3-10(4-2)8-9-6-5-7-11-9/h5-7H,3-4,8H2,1-2H3
InChIKeyZYVYZCLEVCIHAE-UHFFFAOYSA-N
XLogP2.59
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.29
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Methyl[(3-methylthiophen-2-yl)methyl]amine hydrochloride
CID 16187615
(2-Thienylmethyl)amine
CID 34005
N,N-Dimethyl-1-(thiophen-2-yl)methanamine
CID 95702
1-(2-Thienylmethyl)piperazine, monohydrochloride
CID 2760623
Bis((thiophen-2-yl)methyl)amine
CID 252453
N-Methyl-1-(thiophen-2-yl)methanamine
CID 436153
1-(Thien-2-ylmethyl)piperazine
CID 566208
4-[[5-(Thiomorpholin-4-ylmethyl)thiophen-2-yl]methyl]thiomorpholine
CID 155558013
(Prop-2-en-1-yl)(thiophen-2-ylmethyl)amine
CID 2560646
Ethyl[(thiophen-2-yl)methyl]amine
CID 4716479
1-(Thiophen-2-ylmethyl)piperidin-4-one
CID 18001837
Di-2-thenylamine hydrochloride
CID 24212013

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(thiophen-2-ylmethyl)ethanamine?
The IUPAC name of N-ethyl-N-(thiophen-2-ylmethyl)ethanamine (CID 69380552) is N-ethyl-N-(thiophen-2-ylmethyl)ethanamine.
What is the SMILES notation for N-ethyl-N-(thiophen-2-ylmethyl)ethanamine?
The canonical SMILES for N-ethyl-N-(thiophen-2-ylmethyl)ethanamine is CCN(CC)Cc1cccs1.
What is the InChIKey of N-ethyl-N-(thiophen-2-ylmethyl)ethanamine?
The InChIKey is ZYVYZCLEVCIHAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NS/c1-3-10(4-2)8-9-6-5-7-11-9/h5-7H,3-4,8H2,1-2H3.
What are the key properties of N-ethyl-N-(thiophen-2-ylmethyl)ethanamine?
N-ethyl-N-(thiophen-2-ylmethyl)ethanamine has a molecular weight of 169.29 g/mol, XLogP of 2.59, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(thiophen-2-ylmethyl)ethanamine is sourced from PubChem (CID 69380552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).