1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine

C9H14N2S — CID 54592926

IUPAC1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine
SMILESCc1csc(C2(N)CCCC2)n1
InChIInChI=1S/C9H14N2S/c1-7-6-12-8(11-7)9(10)4-2-3-5-9/h6H,2-5,10H2,1H3
InChIKeyXBURDQJIFLAWCC-UHFFFAOYSA-N
MW182.29 g/mol
LogP2.18
Rot. Bonds1

About 1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine

1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine (PubChem CID 54592926) has the molecular formula C9H14N2S and a molecular weight of 182.29 g/mol. Its IUPAC name is 1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine
PubChem CID54592926
Molecular FormulaC9H14N2S
Molecular Weight182.29 g/mol
Exact Mass182.09
IUPAC Name1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine
SMILESCc1csc(C2(N)CCCC2)n1
InChIInChI=1S/C9H14N2S/c1-7-6-12-8(11-7)9(10)4-2-3-5-9/h6H,2-5,10H2,1H3
InChIKeyXBURDQJIFLAWCC-UHFFFAOYSA-N
XLogP2.18
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine?
The IUPAC name of 1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine (CID 54592926) is 1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine.
What is the SMILES notation for 1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine?
The canonical SMILES for 1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine is Cc1csc(C2(N)CCCC2)n1.
What is the InChIKey of 1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine?
The InChIKey is XBURDQJIFLAWCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2S/c1-7-6-12-8(11-7)9(10)4-2-3-5-9/h6H,2-5,10H2,1H3.
What are the key properties of 1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine?
1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine has a molecular weight of 182.29 g/mol, XLogP of 2.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 54592926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).