1,1-bis(ethenyl)-3-ethylurea

C7H12N2O — CID 87783514

IUPAC1,1-bis(ethenyl)-3-ethylurea
SMILESC=CN(C=C)C(=O)NCC
InChIInChI=1S/C7H12N2O/c1-4-8-7(10)9(5-2)6-3/h5-6H,2-4H2,1H3,(H,8,10)
InChIKeyLLRXHDXIJPIPAJ-UHFFFAOYSA-N
MW140.19 g/mol
LogP1.30
Rot. Bonds3

About 1,1-bis(ethenyl)-3-ethylurea

1,1-bis(ethenyl)-3-ethylurea (PubChem CID 87783514) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 1,1-bis(ethenyl)-3-ethylurea.

Molecular Properties

Compound Name1,1-bis(ethenyl)-3-ethylurea
PubChem CID87783514
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name1,1-bis(ethenyl)-3-ethylurea
SMILESC=CN(C=C)C(=O)NCC
InChIInChI=1S/C7H12N2O/c1-4-8-7(10)9(5-2)6-3/h5-6H,2-4H2,1H3,(H,8,10)
InChIKeyLLRXHDXIJPIPAJ-UHFFFAOYSA-N
XLogP1.30
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1-bis(ethenyl)-3-ethylurea?
The IUPAC name of 1,1-bis(ethenyl)-3-ethylurea (CID 87783514) is 1,1-bis(ethenyl)-3-ethylurea.
What is the SMILES notation for 1,1-bis(ethenyl)-3-ethylurea?
The canonical SMILES for 1,1-bis(ethenyl)-3-ethylurea is C=CN(C=C)C(=O)NCC.
What is the InChIKey of 1,1-bis(ethenyl)-3-ethylurea?
The InChIKey is LLRXHDXIJPIPAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-4-8-7(10)9(5-2)6-3/h5-6H,2-4H2,1H3,(H,8,10).
What are the key properties of 1,1-bis(ethenyl)-3-ethylurea?
1,1-bis(ethenyl)-3-ethylurea has a molecular weight of 140.19 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(ethenyl)-3-ethylurea is sourced from PubChem (CID 87783514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).