1,1-diethyl-3-prop-1-en-2-ylurea

C8H16N2O — CID 108910320

IUPAC1,1-diethyl-3-prop-1-en-2-ylurea
SMILESC=C(C)NC(=O)N(CC)CC
InChIInChI=1S/C8H16N2O/c1-5-10(6-2)8(11)9-7(3)4/h3,5-6H2,1-2,4H3,(H,9,11)
InChIKeyJTUKTSYZXSDJNU-UHFFFAOYSA-N
MW156.23 g/mol
LogP1.57
Rot. Bonds3

About 1,1-diethyl-3-prop-1-en-2-ylurea

1,1-diethyl-3-prop-1-en-2-ylurea (PubChem CID 108910320) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 1,1-diethyl-3-prop-1-en-2-ylurea.

Molecular Properties

Compound Name1,1-diethyl-3-prop-1-en-2-ylurea
PubChem CID108910320
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name1,1-diethyl-3-prop-1-en-2-ylurea
SMILESC=C(C)NC(=O)N(CC)CC
InChIInChI=1S/C8H16N2O/c1-5-10(6-2)8(11)9-7(3)4/h3,5-6H2,1-2,4H3,(H,9,11)
InChIKeyJTUKTSYZXSDJNU-UHFFFAOYSA-N
XLogP1.57
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1,1-diethyl-3-prop-1-en-2-ylurea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,4-dimethyl-2,3-dihydro-1H-imidazol-2-one
CID 22035327
1-Butyl-5-methyl-2-imidazolone
CID 26434
2-(Diethylamino)prop-2-enylurea
CID 20522159
3-ethyl-4-methyl-1H-imidazol-2-one
CID 55287036
N-tert-butyl-4-prop-1-en-2-ylpiperazine-1-carboxamide
CID 58171862
N-methyl-4-prop-1-en-2-ylpiperazine-1-carboxamide
CID 58542243
5-ethyl-3-propyl-1H-imidazol-2-one
CID 69521209
4-methyl-3-propan-2-yl-1H-imidazol-2-one
CID 81446268
4-methyl-1-(propan-2-yl)-2,3-dihydro-1H-imidazol-2-one
CID 81446270
1-ethyl-4-methyl-2,3-dihydro-1H-imidazol-2-one
CID 81448417
1,1-Dimethyl-3-prop-1-en-2-ylurea
CID 88958871
1-Methyl-1-(prop-1-en-2-ylcarbamoyl)-3-propylurea
CID 88981943

Frequently Asked Questions

What is the IUPAC name of 1,1-diethyl-3-prop-1-en-2-ylurea?
The IUPAC name of 1,1-diethyl-3-prop-1-en-2-ylurea (CID 108910320) is 1,1-diethyl-3-prop-1-en-2-ylurea.
What is the SMILES notation for 1,1-diethyl-3-prop-1-en-2-ylurea?
The canonical SMILES for 1,1-diethyl-3-prop-1-en-2-ylurea is C=C(C)NC(=O)N(CC)CC.
What is the InChIKey of 1,1-diethyl-3-prop-1-en-2-ylurea?
The InChIKey is JTUKTSYZXSDJNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-5-10(6-2)8(11)9-7(3)4/h3,5-6H2,1-2,4H3,(H,9,11).
What are the key properties of 1,1-diethyl-3-prop-1-en-2-ylurea?
1,1-diethyl-3-prop-1-en-2-ylurea has a molecular weight of 156.23 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-diethyl-3-prop-1-en-2-ylurea is sourced from PubChem (CID 108910320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).