[5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone

C14H15N5OS — CID 56919250

IUPAC[5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone
SMILESO=C(c1nc2sccn2c1-c1ncc[nH]1)N1CCCCC1
InChIInChI=1S/C14H15N5OS/c20-13(18-6-2-1-3-7-18)10-11(12-15-4-5-16-12)19-8-9-21-14(19)17-10/h4-5,8-9H,1-3,6-7H2,(H,15,16)
InChIKeyMSKQNSZPBSQVQT-UHFFFAOYSA-N
MW301.37 g/mol
LogP2.41
Rot. Bonds2

About [5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone

[5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone (PubChem CID 56919250) has the molecular formula C14H15N5OS and a molecular weight of 301.37 g/mol. Its IUPAC name is [5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone.

Molecular Properties

Compound Name[5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone
PubChem CID56919250
Molecular FormulaC14H15N5OS
Molecular Weight301.37 g/mol
Exact Mass301.10
IUPAC Name[5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone
SMILESO=C(c1nc2sccn2c1-c1ncc[nH]1)N1CCCCC1
InChIInChI=1S/C14H15N5OS/c20-13(18-6-2-1-3-7-18)10-11(12-15-4-5-16-12)19-8-9-21-14(19)17-10/h4-5,8-9H,1-3,6-7H2,(H,15,16)
InChIKeyMSKQNSZPBSQVQT-UHFFFAOYSA-N
XLogP2.41
TPSA66.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone?
The IUPAC name of [5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone (CID 56919250) is [5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone.
What is the SMILES notation for [5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone?
The canonical SMILES for [5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone is O=C(c1nc2sccn2c1-c1ncc[nH]1)N1CCCCC1.
What is the InChIKey of [5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone?
The InChIKey is MSKQNSZPBSQVQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5OS/c20-13(18-6-2-1-3-7-18)10-11(12-15-4-5-16-12)19-8-9-21-14(19)17-10/h4-5,8-9H,1-3,6-7H2,(H,15,16).
What are the key properties of [5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone?
[5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone has a molecular weight of 301.37 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1H-imidazol-2-yl)imidazo[2,1-b][1,3]thiazol-6-yl]-piperidin-1-ylmethanone is sourced from PubChem (CID 56919250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).