2-hydroxypropylurea

C4H10N2O2 — CID 11528340

IUPAC2-hydroxypropylurea
SMILESCC(O)CNC(N)=O
InChIInChI=1S/C4H10N2O2/c1-3(7)2-6-4(5)8/h3,7H,2H2,1H3,(H3,5,6,8)
InChIKeyVHEYHMGSWDZXEN-UHFFFAOYSA-N
MW118.14 g/mol
LogP-0.96
Rot. Bonds2

About 2-hydroxypropylurea

2-hydroxypropylurea (PubChem CID 11528340) has the molecular formula C4H10N2O2 and a molecular weight of 118.14 g/mol. Its IUPAC name is 2-hydroxypropylurea.

Molecular Properties

Compound Name2-hydroxypropylurea
PubChem CID11528340
Molecular FormulaC4H10N2O2
Molecular Weight118.14 g/mol
Exact Mass118.07
IUPAC Name2-hydroxypropylurea
SMILESCC(O)CNC(N)=O
InChIInChI=1S/C4H10N2O2/c1-3(7)2-6-4(5)8/h3,7H,2H2,1H3,(H3,5,6,8)
InChIKeyVHEYHMGSWDZXEN-UHFFFAOYSA-N
XLogP-0.96
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.14
LogP ≤ 5-0.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxypropylurea?
The IUPAC name of 2-hydroxypropylurea (CID 11528340) is 2-hydroxypropylurea.
What is the SMILES notation for 2-hydroxypropylurea?
The canonical SMILES for 2-hydroxypropylurea is CC(O)CNC(N)=O.
What is the InChIKey of 2-hydroxypropylurea?
The InChIKey is VHEYHMGSWDZXEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O2/c1-3(7)2-6-4(5)8/h3,7H,2H2,1H3,(H3,5,6,8).
What are the key properties of 2-hydroxypropylurea?
2-hydroxypropylurea has a molecular weight of 118.14 g/mol, XLogP of -0.96, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxypropylurea is sourced from PubChem (CID 11528340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).