1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea

C11H17N3O2 — CID 106415590

IUPAC1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea
SMILESO=C(NCc1ccno1)NC1CCCCC1
InChIInChI=1S/C11H17N3O2/c15-11(12-8-10-6-7-13-16-10)14-9-4-2-1-3-5-9/h6-7,9H,1-5,8H2,(H2,12,14,15)
InChIKeyYUBPOYWOTYKHJG-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.81
Rot. Bonds3

About 1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea

1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea (PubChem CID 106415590) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea.

Molecular Properties

Compound Name1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea
PubChem CID106415590
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea
SMILESO=C(NCc1ccno1)NC1CCCCC1
InChIInChI=1S/C11H17N3O2/c15-11(12-8-10-6-7-13-16-10)14-9-4-2-1-3-5-9/h6-7,9H,1-5,8H2,(H2,12,14,15)
InChIKeyYUBPOYWOTYKHJG-UHFFFAOYSA-N
XLogP1.81
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-2-(1,2-oxazol-5-ylmethylamino)acetamide
CID 106417572
2-[cyclopentyl(1,2-oxazol-5-ylmethylcarbamoyl)amino]acetic acid
CID 106421064
1-tert-butyl-3-(1,2-oxazol-5-ylmethyl)urea
CID 106415604
N-(1,2-oxazol-5-ylmethyl)acetamide
CID 103939766
1-cyclohexyl-3-(1,3-thiazol-5-ylmethyl)urea
CID 104588445
1-cyclohexyl-3-(furan-3-ylmethyl)urea
CID 47236948
N-cyclobutyl-1,2-oxazole-5-carboxamide
CID 126857173
1-[[4-(aminomethyl)phenyl]methyl]-3-cyclohexylurea
CID 54936547
1-cyclohexyl-3-[(3-methyl-4-pyridinyl)methyl]urea
CID 114699395
2-[(cycloheptylcarbamoylamino)methyl]pyridine-4-carboxylic acid
CID 114325102
1-butyl-3-(1,2-oxazol-5-ylmethyl)urea
CID 106415574
3-methyl-N-(1,2-oxazol-5-ylmethyl)piperidine-1-carboxamide
CID 106415578

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea?
The IUPAC name of 1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea (CID 106415590) is 1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea.
What is the SMILES notation for 1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea?
The canonical SMILES for 1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea is O=C(NCc1ccno1)NC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea?
The InChIKey is YUBPOYWOTYKHJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c15-11(12-8-10-6-7-13-16-10)14-9-4-2-1-3-5-9/h6-7,9H,1-5,8H2,(H2,12,14,15).
What are the key properties of 1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea?
1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea has a molecular weight of 223.28 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-(1,2-oxazol-5-ylmethyl)urea is sourced from PubChem (CID 106415590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).