2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine

C12H19NS — CID 115863467

IUPAC2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine
SMILESCCc1ccsc1C(N)CC1CCC1
InChIInChI=1S/C12H19NS/c1-2-10-6-7-14-12(10)11(13)8-9-4-3-5-9/h6-7,9,11H,2-5,8,13H2,1H3
InChIKeyHBCVSDPSPQRSGA-UHFFFAOYSA-N
MW209.36 g/mol
LogP3.50
Rot. Bonds4

About 2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine

2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine (PubChem CID 115863467) has the molecular formula C12H19NS and a molecular weight of 209.36 g/mol. Its IUPAC name is 2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine.

Molecular Properties

Compound Name2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine
PubChem CID115863467
Molecular FormulaC12H19NS
Molecular Weight209.36 g/mol
Exact Mass209.12
IUPAC Name2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine
SMILESCCc1ccsc1C(N)CC1CCC1
InChIInChI=1S/C12H19NS/c1-2-10-6-7-14-12(10)11(13)8-9-4-3-5-9/h6-7,9,11H,2-5,8,13H2,1H3
InChIKeyHBCVSDPSPQRSGA-UHFFFAOYSA-N
XLogP3.50
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.36
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-1-(3-ethylthiophen-2-yl)ethanamine
CID 104986347
2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanol
CID 115802549
(1S)-1-(3-bromothiophen-2-yl)-2-cyclopropylethanamine
CID 130739172
1-(3-ethylcyclohexyl)-1-(3-ethylthiophen-2-yl)-N-methylmethanamine
CID 104992362
1-(3-ethylthiophen-2-yl)hexan-1-amine
CID 115837119
2-cyclohexyl-1-(2-methylthiophen-3-yl)ethanamine
CID 102841282
1-(3-ethylthiophen-2-yl)-4,4-dimethylpentan-1-amine
CID 115849809
2-cyclopentyl-1-(2-ethylphenyl)ethanamine
CID 115847413
1-(3-methylthiophen-2-yl)-2-piperidin-4-ylethanamine
CID 116936534
1-(3-methylthiophen-2-yl)-2-piperidin-3-ylethanamine
CID 116936426
2-cyclobutyl-1-(4-ethylthiadiazol-5-yl)ethanamine
CID 105151524
N-[2-cyclopropyl-1-(3-ethylthiophen-2-yl)ethyl]propan-1-amine
CID 104986473

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine?
The IUPAC name of 2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine (CID 115863467) is 2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine.
What is the SMILES notation for 2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine?
The canonical SMILES for 2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine is CCc1ccsc1C(N)CC1CCC1.
What is the InChIKey of 2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine?
The InChIKey is HBCVSDPSPQRSGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NS/c1-2-10-6-7-14-12(10)11(13)8-9-4-3-5-9/h6-7,9,11H,2-5,8,13H2,1H3.
What are the key properties of 2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine?
2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine has a molecular weight of 209.36 g/mol, XLogP of 3.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine is sourced from PubChem (CID 115863467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).