1-cyclopropyl-3-ethyl-1,3-dimethylurea

C8H16N2O — CID 116654142

IUPAC1-cyclopropyl-3-ethyl-1,3-dimethylurea
SMILESCCN(C)C(=O)N(C)C1CC1
InChIInChI=1S/C8H16N2O/c1-4-9(2)8(11)10(3)7-5-6-7/h7H,4-6H2,1-3H3
InChIKeyPDXZQFRMOHZRNL-UHFFFAOYSA-N
MW156.23 g/mol
LogP1.15
Rot. Bonds2

About 1-cyclopropyl-3-ethyl-1,3-dimethylurea

1-cyclopropyl-3-ethyl-1,3-dimethylurea (PubChem CID 116654142) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 1-cyclopropyl-3-ethyl-1,3-dimethylurea.

Molecular Properties

Compound Name1-cyclopropyl-3-ethyl-1,3-dimethylurea
PubChem CID116654142
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name1-cyclopropyl-3-ethyl-1,3-dimethylurea
SMILESCCN(C)C(=O)N(C)C1CC1
InChIInChI=1S/C8H16N2O/c1-4-9(2)8(11)10(3)7-5-6-7/h7H,4-6H2,1-3H3
InChIKeyPDXZQFRMOHZRNL-UHFFFAOYSA-N
XLogP1.15
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-cyclopropyl-3-ethyl-1,3-dimethylurea 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-cyclopropyl-3-ethyl-3-methyl-1-prop-2-enylurea
CID 116657097
1,3-dimethyl-1-(1-methylpiperidin-4-yl)-3-propylurea
CID 143486621
3-[methyl-[methyl-(4-methylcyclohexyl)carbamoyl]amino]propanoic acid
CID 61439567
1-cyclobutyl-3-ethyl-1-(2-hydroxyethyl)-3-methylurea
CID 102861332
1-cyclopropyl-3-ethyl-3-methyl-1-(piperidin-4-ylmethyl)urea
CID 79716976
2-[ethyl-[methyl-(4-methylcyclohexyl)carbamoyl]amino]-2-methylpropanoic acid
CID 62821662
1-cyclopropyl-3-ethyl-3-methyl-1-(piperidin-2-ylmethyl)urea
CID 106629707
1,1,3-trimethyl-3-[4-(propylamino)cyclohexyl]urea
CID 79153266
4-[cyclopropyl(methyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103495905
3-[[cyclopentyl(methyl)carbamoyl]-ethylamino]propanoic acid
CID 61194349
1-cyclopentyl-3-ethyl-3-methyl-1-(3-methylbutyl)urea
CID 116656765
2-[ethyl-[methyl-(1-methylpiperidin-4-yl)carbamoyl]amino]acetic acid
CID 61191644

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-ethyl-1,3-dimethylurea?
The IUPAC name of 1-cyclopropyl-3-ethyl-1,3-dimethylurea (CID 116654142) is 1-cyclopropyl-3-ethyl-1,3-dimethylurea.
What is the SMILES notation for 1-cyclopropyl-3-ethyl-1,3-dimethylurea?
The canonical SMILES for 1-cyclopropyl-3-ethyl-1,3-dimethylurea is CCN(C)C(=O)N(C)C1CC1.
What is the InChIKey of 1-cyclopropyl-3-ethyl-1,3-dimethylurea?
The InChIKey is PDXZQFRMOHZRNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-4-9(2)8(11)10(3)7-5-6-7/h7H,4-6H2,1-3H3.
What are the key properties of 1-cyclopropyl-3-ethyl-1,3-dimethylurea?
1-cyclopropyl-3-ethyl-1,3-dimethylurea has a molecular weight of 156.23 g/mol, XLogP of 1.15, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-ethyl-1,3-dimethylurea is sourced from PubChem (CID 116654142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).