3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine

C12H20N2S — CID 64923336

IUPAC3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine
SMILESCCC1CCC(NCc2nccs2)C1C
InChIInChI=1S/C12H20N2S/c1-3-10-4-5-11(9(10)2)14-8-12-13-6-7-15-12/h6-7,9-11,14H,3-5,8H2,1-2H3
InChIKeyODGMYFUTXNFGIF-UHFFFAOYSA-N
MW224.37 g/mol
LogP3.06
Rot. Bonds4

About 3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine

3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine (PubChem CID 64923336) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is 3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine
PubChem CID64923336
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC Name3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine
SMILESCCC1CCC(NCc2nccs2)C1C
InChIInChI=1S/C12H20N2S/c1-3-10-4-5-11(9(10)2)14-8-12-13-6-7-15-12/h6-7,9-11,14H,3-5,8H2,1-2H3
InChIKeyODGMYFUTXNFGIF-UHFFFAOYSA-N
XLogP3.06
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-3-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine
CID 79823752
4-methyl-N-(1,3-thiazol-2-ylmethyl)thiolan-3-amine
CID 130519810
3-ethyl-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]cyclopentan-1-amine
CID 112650199
4-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine
CID 58902693
N-benzyl-3-ethyl-2-methylcyclopentan-1-amine
CID 64920559
N-[(5-bromothiophen-2-yl)methyl]-3-ethyl-2-methylcyclopentan-1-amine
CID 64921526
3-[[(3-ethyl-2-methylcyclopentyl)amino]methyl]pyridine-2-carbonitrile
CID 64921974
3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine
CID 60961816
N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-2-amine
CID 114273439
N-(3-ethyl-2-methylcyclopentyl)thieno[2,3-d]pyrimidin-4-amine
CID 64923589
3-ethyl-2-methyl-N-(1H-pyrrol-3-ylmethyl)cyclopentan-1-amine
CID 66409422
3-ethyl-2-methyl-N-[(4-methylsulfanylphenyl)methyl]cyclopentan-1-amine
CID 64921530

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine?
The IUPAC name of 3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine (CID 64923336) is 3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for 3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for 3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine is CCC1CCC(NCc2nccs2)C1C.
What is the InChIKey of 3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine?
The InChIKey is ODGMYFUTXNFGIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c1-3-10-4-5-11(9(10)2)14-8-12-13-6-7-15-12/h6-7,9-11,14H,3-5,8H2,1-2H3.
What are the key properties of 3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine?
3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine has a molecular weight of 224.37 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-methyl-N-(1,3-thiazol-2-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 64923336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).