cyclobutylurea;ethane

C7H16N2O — CID 145319429

IUPACcyclobutylurea;ethane
SMILESCC.NC(=O)NC1CCC1
InChIInChI=1S/C5H10N2O.C2H6/c6-5(8)7-4-2-1-3-4;1-2/h4H,1-3H2,(H3,6,7,8);1-2H3
InChIKeyRCKPXRSJPAWOSB-UHFFFAOYSA-N
MW144.22 g/mol
LogP1.23
Rot. Bonds1

About cyclobutylurea;ethane

cyclobutylurea;ethane (PubChem CID 145319429) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is cyclobutylurea;ethane.

Molecular Properties

Compound Namecyclobutylurea;ethane
PubChem CID145319429
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Namecyclobutylurea;ethane
SMILESCC.NC(=O)NC1CCC1
InChIInChI=1S/C5H10N2O.C2H6/c6-5(8)7-4-2-1-3-4;1-2/h4H,1-3H2,(H3,6,7,8);1-2H3
InChIKeyRCKPXRSJPAWOSB-UHFFFAOYSA-N
XLogP1.23
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

cyclohexylurea;methanamine
CID 142108304
1,3-bis[4-(carbamoylamino)cyclohexyl]urea
CID 163452854
acetaldehyde;ethane;[4-(methylamino)cyclohexyl]urea
CID 144985751
(4-chlorocyclohexyl)urea
CID 86732946
[(1S,5R)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]urea
CID 70078455
[4-(ethylamino)cyclohexyl]urea
CID 43653665
[4-(dimethylamino)cyclohexyl]urea
CID 59286114
methyl 4-(carbamoylamino)cyclohexane-1-carboxylate
CID 47585856
spiro[5.5]undecan-3-ylurea
CID 91662332
N-cyclopentylcyclobutanecarboxamide
CID 21158774
(2-methylcyclopentyl)urea
CID 63281869
[4-(aminomethyl)cyclohexyl]urea
CID 130538291

Frequently Asked Questions

What is the IUPAC name of cyclobutylurea;ethane?
The IUPAC name of cyclobutylurea;ethane (CID 145319429) is cyclobutylurea;ethane.
What is the SMILES notation for cyclobutylurea;ethane?
The canonical SMILES for cyclobutylurea;ethane is CC.NC(=O)NC1CCC1.
What is the InChIKey of cyclobutylurea;ethane?
The InChIKey is RCKPXRSJPAWOSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O.C2H6/c6-5(8)7-4-2-1-3-4;1-2/h4H,1-3H2,(H3,6,7,8);1-2H3.
What are the key properties of cyclobutylurea;ethane?
cyclobutylurea;ethane has a molecular weight of 144.22 g/mol, XLogP of 1.23, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutylurea;ethane is sourced from PubChem (CID 145319429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).