[3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea

C10H15N3O2 — CID 68734787

IUPAC[3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea
SMILESCC1(c2cc(NC(N)=O)on2)CCCC1
InChIInChI=1S/C10H15N3O2/c1-10(4-2-3-5-10)7-6-8(15-13-7)12-9(11)14/h6H,2-5H2,1H3,(H3,11,12,14)
InChIKeyVRBHKXSCTFIUPL-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.00
Rot. Bonds2

About [3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea

[3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea (PubChem CID 68734787) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is [3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea.

Molecular Properties

Compound Name[3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea
PubChem CID68734787
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name[3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea
SMILESCC1(c2cc(NC(N)=O)on2)CCCC1
InChIInChI=1S/C10H15N3O2/c1-10(4-2-3-5-10)7-6-8(15-13-7)12-9(11)14/h6H,2-5H2,1H3,(H3,11,12,14)
InChIKeyVRBHKXSCTFIUPL-UHFFFAOYSA-N
XLogP2.00
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea?
The IUPAC name of [3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea (CID 68734787) is [3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea.
What is the SMILES notation for [3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea?
The canonical SMILES for [3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea is CC1(c2cc(NC(N)=O)on2)CCCC1.
What is the InChIKey of [3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea?
The InChIKey is VRBHKXSCTFIUPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-10(4-2-3-5-10)7-6-8(15-13-7)12-9(11)14/h6H,2-5H2,1H3,(H3,11,12,14).
What are the key properties of [3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea?
[3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea has a molecular weight of 209.25 g/mol, XLogP of 2.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1-methylcyclopentyl)-1,2-oxazol-5-yl]urea is sourced from PubChem (CID 68734787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).