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

C11H13N3S2 — CID 64988732

IUPAC1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine
SMILESNC1(c2nc(-c3nccs3)cs2)CCCC1
InChIInChI=1S/C11H13N3S2/c12-11(3-1-2-4-11)10-14-8(7-16-10)9-13-5-6-15-9/h5-7H,1-4,12H2
InChIKeyZCWUFUJFTLSGFV-UHFFFAOYSA-N
MW251.38 g/mol
LogP2.99
Rot. Bonds2

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

1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine (PubChem CID 64988732) has the molecular formula C11H13N3S2 and a molecular weight of 251.38 g/mol. Its IUPAC name is 1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine.

Molecular Properties

Compound Name1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine
PubChem CID64988732
Molecular FormulaC11H13N3S2
Molecular Weight251.38 g/mol
Exact Mass251.06
IUPAC Name1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine
SMILESNC1(c2nc(-c3nccs3)cs2)CCCC1
InChIInChI=1S/C11H13N3S2/c12-11(3-1-2-4-11)10-14-8(7-16-10)9-13-5-6-15-9/h5-7H,1-4,12H2
InChIKeyZCWUFUJFTLSGFV-UHFFFAOYSA-N
XLogP2.99
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.38
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine?
The IUPAC name of 1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine (CID 64988732) is 1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine.
What is the SMILES notation for 1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine?
The canonical SMILES for 1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine is NC1(c2nc(-c3nccs3)cs2)CCCC1.
What is the InChIKey of 1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine?
The InChIKey is ZCWUFUJFTLSGFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3S2/c12-11(3-1-2-4-11)10-14-8(7-16-10)9-13-5-6-15-9/h5-7H,1-4,12H2.
What are the key properties of 1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine?
1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine has a molecular weight of 251.38 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1,3-thiazol-2-yl)-1,3-thiazol-2-yl]cyclopentan-1-amine is sourced from PubChem (CID 64988732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).