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

C9H14N2S — CID 61332103

IUPACN-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine
SMILESCNC1(c2nccs2)CCCC1
InChIInChI=1S/C9H14N2S/c1-10-9(4-2-3-5-9)8-11-6-7-12-8/h6-7,10H,2-5H2,1H3
InChIKeyZVCYQPDAHWYZSR-UHFFFAOYSA-N
MW182.29 g/mol
LogP2.13
Rot. Bonds2

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

N-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine (PubChem CID 61332103) has the molecular formula C9H14N2S and a molecular weight of 182.29 g/mol. Its IUPAC name is N-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine
PubChem CID61332103
Molecular FormulaC9H14N2S
Molecular Weight182.29 g/mol
Exact Mass182.09
IUPAC NameN-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine
SMILESCNC1(c2nccs2)CCCC1
InChIInChI=1S/C9H14N2S/c1-10-9(4-2-3-5-9)8-11-6-7-12-8/h6-7,10H,2-5H2,1H3
InChIKeyZVCYQPDAHWYZSR-UHFFFAOYSA-N
XLogP2.13
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine?
The IUPAC name of N-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine (CID 61332103) is N-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine.
What is the SMILES notation for N-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine?
The canonical SMILES for N-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine is CNC1(c2nccs2)CCCC1.
What is the InChIKey of N-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine?
The InChIKey is ZVCYQPDAHWYZSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2S/c1-10-9(4-2-3-5-9)8-11-6-7-12-8/h6-7,10H,2-5H2,1H3.
What are the key properties of N-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine?
N-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine has a molecular weight of 182.29 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 61332103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).