1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea

C10H16N2O3 — CID 156816114

IUPAC1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea
SMILESO=C(NCC1CCC1)NC1CCOC1=O
InChIInChI=1S/C10H16N2O3/c13-9-8(4-5-15-9)12-10(14)11-6-7-2-1-3-7/h7-8H,1-6H2,(H2,11,12,14)
InChIKeyWDVWKPRMTLIZQE-UHFFFAOYSA-N
MW212.25 g/mol
LogP0.40
Rot. Bonds3

About 1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea

1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea (PubChem CID 156816114) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is 1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea.

Molecular Properties

Compound Name1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea
PubChem CID156816114
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC Name1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea
SMILESO=C(NCC1CCC1)NC1CCOC1=O
InChIInChI=1S/C10H16N2O3/c13-9-8(4-5-15-9)12-10(14)11-6-7-2-1-3-7/h7-8H,1-6H2,(H2,11,12,14)
InChIKeyWDVWKPRMTLIZQE-UHFFFAOYSA-N
XLogP0.40
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethyl-3-[(3S)-2-oxooxolan-3-yl]urea
CID 127013922
oxo-bis[2-oxo-2-[(2-oxooxolan-3-yl)amino]ethoxy]azanium
CID 90133688
1-(cyclobutylmethyl)-3-(cyclohexylmethyl)urea
CID 155200065
1-(cyclopentylmethyl)-3-(2-methylcyclohexyl)urea
CID 108902589
1-(cyclooctylmethyl)-3-cyclopropylurea
CID 87025156
1-cyclododecyl-3-(cyclohexylmethyl)urea
CID 108902864
2-methyl-N-(2-oxooxolan-3-yl)propanamide
CID 23020667
[2-oxo-2-[(2-oxooxolan-3-yl)amino]ethyl] nitrate
CID 90133686
1-ethyl-3-[(3S)-2-oxooxolan-3-yl]thiourea
CID 130891062
1-cyclopropyl-3-[[(1R,3R)-3-[(cyclopropylcarbamoylamino)methyl]cyclohexyl]methyl]urea
CID 26974860
6-oxo-6-[(2-oxooxolan-3-yl)amino]hexanoic acid
CID 65418345
N-(2-oxooxolan-3-yl)pentanamide
CID 11513883

Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea?
The IUPAC name of 1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea (CID 156816114) is 1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea.
What is the SMILES notation for 1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea?
The canonical SMILES for 1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea is O=C(NCC1CCC1)NC1CCOC1=O.
What is the InChIKey of 1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea?
The InChIKey is WDVWKPRMTLIZQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c13-9-8(4-5-15-9)12-10(14)11-6-7-2-1-3-7/h7-8H,1-6H2,(H2,11,12,14).
What are the key properties of 1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea?
1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea has a molecular weight of 212.25 g/mol, XLogP of 0.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethyl)-3-(2-oxooxolan-3-yl)urea is sourced from PubChem (CID 156816114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).