1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea

C6H12N2O2 — CID 108909598

IUPAC1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea
SMILESC/C=C/NC(=O)NCCO
InChIInChI=1S/C6H12N2O2/c1-2-3-7-6(10)8-4-5-9/h2-3,9H,4-5H2,1H3,(H2,7,8,10)/b3-2+
InChIKeyZOXIDDFVLJFKTA-NSCUHMNNSA-N
MW144.17 g/mol
LogP-0.19
Rot. Bonds3

About 1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea

1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea (PubChem CID 108909598) has the molecular formula C6H12N2O2 and a molecular weight of 144.17 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea.

Molecular Properties

Compound Name1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea
PubChem CID108909598
Molecular FormulaC6H12N2O2
Molecular Weight144.17 g/mol
Exact Mass144.09
IUPAC Name1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea
SMILESC/C=C/NC(=O)NCCO
InChIInChI=1S/C6H12N2O2/c1-2-3-7-6(10)8-4-5-9/h2-3,9H,4-5H2,1H3,(H2,7,8,10)/b3-2+
InChIKeyZOXIDDFVLJFKTA-NSCUHMNNSA-N
XLogP-0.19
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.17
LogP ≤ 5-0.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea?
The IUPAC name of 1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea (CID 108909598) is 1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea.
What is the SMILES notation for 1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea?
The canonical SMILES for 1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea is C/C=C/NC(=O)NCCO.
What is the InChIKey of 1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea?
The InChIKey is ZOXIDDFVLJFKTA-NSCUHMNNSA-N. The full InChI is InChI=1S/C6H12N2O2/c1-2-3-7-6(10)8-4-5-9/h2-3,9H,4-5H2,1H3,(H2,7,8,10)/b3-2+.
What are the key properties of 1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea?
1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea has a molecular weight of 144.17 g/mol, XLogP of -0.19, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)-3-[(E)-prop-1-enyl]urea is sourced from PubChem (CID 108909598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).