chempirical

Propylurea

C4H10N2OCAS 627-06-5102.14 g/mol

Open in Covalent MOL file
NHNH2O

Properties

Molecular formula
C4H10N2O
Molar mass
102.14 g/mol
Exact mass
102.0793 Da
Melting point
107 °C
logP
0.48Crippen estimate
Polar surface area
56.1 Ų
H-bond donors / acceptors
3 / 1
Rotatable bonds
2

Identifiers

CAS number
627-06-5
SMILES
CCCNC(=N)O
InChIKey
ZQZJKHIIQFPZCS-UHFFFAOYSA-N
InChI
InChI=1S/C4H10N2O/c1-2-3-6-4(5)7/h2-3H2,1H3,(H3,5,6,7)

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Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • Urea, N-propyl-
  • Urea, propyl-
  • N-Propylurea
  • 1-Propylurea
  • NSC 73471

Work with Propylurea

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Butylurea592-31-477 % similar N-Octadecylurea2158-08-974 % similar Ethylurea625-52-557 % similar (2-Hydroxyethyl)urea2078-71-954 % similar Isobutylurea592-17-650 % similar N-Propylthiourea927-67-350 % similar Ureidopropyltriethoxysilane23779-32-047 % similar Methylol urea1000-82-446 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

N-Acetylethylenediamine1001-53-2 (2S)-2-Aminobutyramide143164-46-9 Butanoic acid hydrazide3538-65-6 Isobutyrohydrazide3619-17-8 4-Morpholinamine4319-49-7 N-Nitrosodiethylamine55-18-5

Elsewhere

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