1-cyclopropyl-3-(1,3-thiazol-2-yl)urea

C7H9N3OS — CID 108887577

IUPAC1-cyclopropyl-3-(1,3-thiazol-2-yl)urea
SMILESO=C(Nc1nccs1)NC1CC1
InChIInChI=1S/C7H9N3OS/c11-6(9-5-1-2-5)10-7-8-3-4-12-7/h3-5H,1-2H2,(H2,8,9,10,11)
InChIKeyPHKHKCPSHDDYQI-UHFFFAOYSA-N
MW183.24 g/mol
LogP1.43
Rot. Bonds2

About 1-cyclopropyl-3-(1,3-thiazol-2-yl)urea

1-cyclopropyl-3-(1,3-thiazol-2-yl)urea (PubChem CID 108887577) has the molecular formula C7H9N3OS and a molecular weight of 183.24 g/mol. Its IUPAC name is 1-cyclopropyl-3-(1,3-thiazol-2-yl)urea.

Molecular Properties

Compound Name1-cyclopropyl-3-(1,3-thiazol-2-yl)urea
PubChem CID108887577
Molecular FormulaC7H9N3OS
Molecular Weight183.24 g/mol
Exact Mass183.05
IUPAC Name1-cyclopropyl-3-(1,3-thiazol-2-yl)urea
SMILESO=C(Nc1nccs1)NC1CC1
InChIInChI=1S/C7H9N3OS/c11-6(9-5-1-2-5)10-7-8-3-4-12-7/h3-5H,1-2H2,(H2,8,9,10,11)
InChIKeyPHKHKCPSHDDYQI-UHFFFAOYSA-N
XLogP1.43
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.24
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1,3-thiazol-2-yl)-3-[4-(1H-1,2,4-triazol-5-yl)cyclohexyl]urea
CID 154871139
1-N-cyclopropyl-4-N-(1,3-thiazol-2-yl)piperidine-1,4-dicarboxamide
CID 47245076
trans-(1R,2R)-2-(1,3-thiazol-2-ylcarbamoylamino)cycloheptane-1-carboxamide
CID 97018542
methyl (1S,2R,3R,4S)-3-(1,3-thiazol-2-ylcarbamoylamino)bicyclo[2.2.1]heptane-2-carboxylate
CID 124866147
2-[4-[(4-methylphenyl)carbamoylamino]piperidin-1-ium-1-yl]-N-(1,3-thiazol-2-yl)acetamide
CID 7216151
1-(3-methoxy-2,2,3-trimethylcyclobutyl)-3-(1,3-thiazol-2-yl)urea
CID 71986302
N-(1,3-thiazol-2-yl)azetidine-2-carboxamide
CID 130992868
1-cycloheptyl-3-(1,3,4-thiadiazol-2-yl)urea
CID 47191642
2-cyclopentyl-N-(1,3-thiazol-2-yl)propanamide
CID 141028315
1-[(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-3-(1,3-thiazol-2-yl)urea
CID 97057644
cis-(1R,2S)-3-methylidene-1-N,2-N-bis(1,3-thiazol-2-yl)cyclopropane-1,2-dicarboxamide
CID 2313436
3-[(1,1-dioxothiolan-3-yl)carbamoylamino]-N-(1,3-thiazol-2-yl)propanamide
CID 42654385

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(1,3-thiazol-2-yl)urea?
The IUPAC name of 1-cyclopropyl-3-(1,3-thiazol-2-yl)urea (CID 108887577) is 1-cyclopropyl-3-(1,3-thiazol-2-yl)urea.
What is the SMILES notation for 1-cyclopropyl-3-(1,3-thiazol-2-yl)urea?
The canonical SMILES for 1-cyclopropyl-3-(1,3-thiazol-2-yl)urea is O=C(Nc1nccs1)NC1CC1.
What is the InChIKey of 1-cyclopropyl-3-(1,3-thiazol-2-yl)urea?
The InChIKey is PHKHKCPSHDDYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3OS/c11-6(9-5-1-2-5)10-7-8-3-4-12-7/h3-5H,1-2H2,(H2,8,9,10,11).
What are the key properties of 1-cyclopropyl-3-(1,3-thiazol-2-yl)urea?
1-cyclopropyl-3-(1,3-thiazol-2-yl)urea has a molecular weight of 183.24 g/mol, XLogP of 1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(1,3-thiazol-2-yl)urea is sourced from PubChem (CID 108887577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).