1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea

C10H15N3OS — CID 47146401

IUPAC1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea
SMILESCc1nc(CCNC(=O)NC2CC2)cs1
InChIInChI=1S/C10H15N3OS/c1-7-12-9(6-15-7)4-5-11-10(14)13-8-2-3-8/h6,8H,2-5H2,1H3,(H2,11,13,14)
InChIKeyPKMNASNKSXRMOL-UHFFFAOYSA-N
MW225.32 g/mol
LogP1.46
Rot. Bonds4

About 1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea

1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea (PubChem CID 47146401) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea.

Molecular Properties

Compound Name1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea
PubChem CID47146401
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea
SMILESCc1nc(CCNC(=O)NC2CC2)cs1
InChIInChI=1S/C10H15N3OS/c1-7-12-9(6-15-7)4-5-11-10(14)13-8-2-3-8/h6,8H,2-5H2,1H3,(H2,11,13,14)
InChIKeyPKMNASNKSXRMOL-UHFFFAOYSA-N
XLogP1.46
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]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-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea?
The IUPAC name of 1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea (CID 47146401) is 1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea.
What is the SMILES notation for 1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea?
The canonical SMILES for 1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea is Cc1nc(CCNC(=O)NC2CC2)cs1.
What is the InChIKey of 1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea?
The InChIKey is PKMNASNKSXRMOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-7-12-9(6-15-7)4-5-11-10(14)13-8-2-3-8/h6,8H,2-5H2,1H3,(H2,11,13,14).
What are the key properties of 1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea?
1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea has a molecular weight of 225.32 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]urea is sourced from PubChem (CID 47146401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).