formamide;urea

C2H7N3O2 — CID 19591694

IUPACformamide;urea
SMILESNC(N)=O.NC=O
InChIInChI=1S/CH4N2O.CH3NO/c2-1(3)4;2-1-3/h(H4,2,3,4);1H,(H2,2,3)
InChIKeyXZSDLFHCPIUHJB-UHFFFAOYSA-N
MW105.10 g/mol
LogP-1.87
Rot. Bonds

About formamide;urea

formamide;urea (PubChem CID 19591694) has the molecular formula C2H7N3O2 and a molecular weight of 105.10 g/mol. Its IUPAC name is formamide;urea.

Molecular Properties

Compound Nameformamide;urea
PubChem CID19591694
Molecular FormulaC2H7N3O2
Molecular Weight105.10 g/mol
Exact Mass105.05
IUPAC Nameformamide;urea
SMILESNC(N)=O.NC=O
InChIInChI=1S/CH4N2O.CH3NO/c2-1(3)4;2-1-3/h(H4,2,3,4);1H,(H2,2,3)
InChIKeyXZSDLFHCPIUHJB-UHFFFAOYSA-N
XLogP-1.87
TPSA112.20 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.10
LogP ≤ 5-1.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of formamide;urea?
The IUPAC name of formamide;urea (CID 19591694) is formamide;urea.
What is the SMILES notation for formamide;urea?
The canonical SMILES for formamide;urea is NC(N)=O.NC=O.
What is the InChIKey of formamide;urea?
The InChIKey is XZSDLFHCPIUHJB-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4N2O.CH3NO/c2-1(3)4;2-1-3/h(H4,2,3,4);1H,(H2,2,3).
What are the key properties of formamide;urea?
formamide;urea has a molecular weight of 105.10 g/mol, XLogP of -1.87, 0 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for formamide;urea is sourced from PubChem (CID 19591694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).