1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine

C12H20N2S — CID 61335208

IUPAC1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine
SMILESCc1csc(C2(NC(C)C)CCCC2)n1
InChIInChI=1S/C12H20N2S/c1-9(2)14-12(6-4-5-7-12)11-13-10(3)8-15-11/h8-9,14H,4-7H2,1-3H3
InChIKeyMFZORFCVEIDOQV-UHFFFAOYSA-N
MW224.37 g/mol
LogP3.22
Rot. Bonds3

About 1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine

1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine (PubChem CID 61335208) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is 1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine.

Molecular Properties

Compound Name1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine
PubChem CID61335208
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC Name1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine
SMILESCc1csc(C2(NC(C)C)CCCC2)n1
InChIInChI=1S/C12H20N2S/c1-9(2)14-12(6-4-5-7-12)11-13-10(3)8-15-11/h8-9,14H,4-7H2,1-3H3
InChIKeyMFZORFCVEIDOQV-UHFFFAOYSA-N
XLogP3.22
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 53.22
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)-N-propan-2-ylcyclopentan-1-amine?
The IUPAC name of 1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine (CID 61335208) is 1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine.
What is the SMILES notation for 1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine?
The canonical SMILES for 1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine is Cc1csc(C2(NC(C)C)CCCC2)n1.
What is the InChIKey of 1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine?
The InChIKey is MFZORFCVEIDOQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c1-9(2)14-12(6-4-5-7-12)11-13-10(3)8-15-11/h8-9,14H,4-7H2,1-3H3.
What are the key properties of 1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine?
1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine has a molecular weight of 224.37 g/mol, XLogP of 3.22, 3 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)-N-propan-2-ylcyclopentan-1-amine is sourced from PubChem (CID 61335208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).