1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea

C14H19N5OS — CID 166185795

IUPAC1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea
SMILESO=C(NCCc1cn2c(n1)CCCC2)NCc1nccs1
InChIInChI=1S/C14H19N5OS/c20-14(17-9-13-15-6-8-21-13)16-5-4-11-10-19-7-2-1-3-12(19)18-11/h6,8,10H,1-5,7,9H2,(H2,16,17,20)
InChIKeyOZCUXXQPOUPVLZ-UHFFFAOYSA-N
MW305.41 g/mol
LogP1.72
Rot. Bonds5

About 1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea

1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea (PubChem CID 166185795) has the molecular formula C14H19N5OS and a molecular weight of 305.41 g/mol. Its IUPAC name is 1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea.

Molecular Properties

Compound Name1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea
PubChem CID166185795
Molecular FormulaC14H19N5OS
Molecular Weight305.41 g/mol
Exact Mass305.13
IUPAC Name1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea
SMILESO=C(NCCc1cn2c(n1)CCCC2)NCc1nccs1
InChIInChI=1S/C14H19N5OS/c20-14(17-9-13-15-6-8-21-13)16-5-4-11-10-19-7-2-1-3-12(19)18-11/h6,8,10H,1-5,7,9H2,(H2,16,17,20)
InChIKeyOZCUXXQPOUPVLZ-UHFFFAOYSA-N
XLogP1.72
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.41
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea?
The IUPAC name of 1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea (CID 166185795) is 1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea.
What is the SMILES notation for 1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea?
The canonical SMILES for 1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea is O=C(NCCc1cn2c(n1)CCCC2)NCc1nccs1.
What is the InChIKey of 1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea?
The InChIKey is OZCUXXQPOUPVLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5OS/c20-14(17-9-13-15-6-8-21-13)16-5-4-11-10-19-7-2-1-3-12(19)18-11/h6,8,10H,1-5,7,9H2,(H2,16,17,20).
What are the key properties of 1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea?
1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea has a molecular weight of 305.41 g/mol, XLogP of 1.72, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]-3-(1,3-thiazol-2-ylmethyl)urea is sourced from PubChem (CID 166185795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).