3-(dimethylamino)prop-2-enylurea

C6H13N3O — CID 57353459

IUPAC3-(dimethylamino)prop-2-enylurea
SMILESCN(C)C=CCNC(N)=O
InChIInChI=1S/C6H13N3O/c1-9(2)5-3-4-8-6(7)10/h3,5H,4H2,1-2H3,(H3,7,8,10)
InChIKeyJENPRDXVVRNPOJ-UHFFFAOYSA-N
MW143.19 g/mol
LogP-0.27
Rot. Bonds3

About 3-(dimethylamino)prop-2-enylurea

3-(dimethylamino)prop-2-enylurea (PubChem CID 57353459) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is 3-(dimethylamino)prop-2-enylurea.

Molecular Properties

Compound Name3-(dimethylamino)prop-2-enylurea
PubChem CID57353459
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC Name3-(dimethylamino)prop-2-enylurea
SMILESCN(C)C=CCNC(N)=O
InChIInChI=1S/C6H13N3O/c1-9(2)5-3-4-8-6(7)10/h3,5H,4H2,1-2H3,(H3,7,8,10)
InChIKeyJENPRDXVVRNPOJ-UHFFFAOYSA-N
XLogP-0.27
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)prop-2-enylurea?
The IUPAC name of 3-(dimethylamino)prop-2-enylurea (CID 57353459) is 3-(dimethylamino)prop-2-enylurea.
What is the SMILES notation for 3-(dimethylamino)prop-2-enylurea?
The canonical SMILES for 3-(dimethylamino)prop-2-enylurea is CN(C)C=CCNC(N)=O.
What is the InChIKey of 3-(dimethylamino)prop-2-enylurea?
The InChIKey is JENPRDXVVRNPOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O/c1-9(2)5-3-4-8-6(7)10/h3,5H,4H2,1-2H3,(H3,7,8,10).
What are the key properties of 3-(dimethylamino)prop-2-enylurea?
3-(dimethylamino)prop-2-enylurea has a molecular weight of 143.19 g/mol, XLogP of -0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)prop-2-enylurea is sourced from PubChem (CID 57353459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).