2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine

C11H18N2S — CID 105138914

IUPAC2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine
SMILESCc1ncsc1C(N)CC1CCCC1
InChIInChI=1S/C11H18N2S/c1-8-11(14-7-13-8)10(12)6-9-4-2-3-5-9/h7,9-10H,2-6,12H2,1H3
InChIKeyFOAHSESCGANEKJ-UHFFFAOYSA-N
MW210.35 g/mol
LogP3.03
Rot. Bonds3

About 2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine

2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine (PubChem CID 105138914) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is 2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine
PubChem CID105138914
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine
SMILESCc1ncsc1C(N)CC1CCCC1
InChIInChI=1S/C11H18N2S/c1-8-11(14-7-13-8)10(12)6-9-4-2-3-5-9/h7,9-10H,2-6,12H2,1H3
InChIKeyFOAHSESCGANEKJ-UHFFFAOYSA-N
XLogP3.03
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine?
The IUPAC name of 2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine (CID 105138914) is 2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine.
What is the SMILES notation for 2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine?
The canonical SMILES for 2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine is Cc1ncsc1C(N)CC1CCCC1.
What is the InChIKey of 2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine?
The InChIKey is FOAHSESCGANEKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-8-11(14-7-13-8)10(12)6-9-4-2-3-5-9/h7,9-10H,2-6,12H2,1H3.
What are the key properties of 2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine?
2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine has a molecular weight of 210.35 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine is sourced from PubChem (CID 105138914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).