1-amino-3-carbamoyl-1,3-dimethylurea

C4H10N4O2 — CID 89086493

IUPAC1-amino-3-carbamoyl-1,3-dimethylurea
SMILESCN(N)C(=O)N(C)C(N)=O
InChIInChI=1S/C4H10N4O2/c1-7(3(5)9)4(10)8(2)6/h6H2,1-2H3,(H2,5,9)
InChIKeyUDDZPJJOQVYYSU-UHFFFAOYSA-N
MW146.15 g/mol
LogP-1.08
Rot. Bonds

About 1-amino-3-carbamoyl-1,3-dimethylurea

1-amino-3-carbamoyl-1,3-dimethylurea (PubChem CID 89086493) has the molecular formula C4H10N4O2 and a molecular weight of 146.15 g/mol. Its IUPAC name is 1-amino-3-carbamoyl-1,3-dimethylurea.

Molecular Properties

Compound Name1-amino-3-carbamoyl-1,3-dimethylurea
PubChem CID89086493
Molecular FormulaC4H10N4O2
Molecular Weight146.15 g/mol
Exact Mass146.08
IUPAC Name1-amino-3-carbamoyl-1,3-dimethylurea
SMILESCN(N)C(=O)N(C)C(N)=O
InChIInChI=1S/C4H10N4O2/c1-7(3(5)9)4(10)8(2)6/h6H2,1-2H3,(H2,5,9)
InChIKeyUDDZPJJOQVYYSU-UHFFFAOYSA-N
XLogP-1.08
TPSA92.66 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 5-1.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1,1-diaminourea;ethane
CID 174870185
N-carbamoyl-2-hydroxy-N-methylacetamide
CID 160682561
1-[amino(methyl)amino]-1-hydroxyurea
CID 134205110
1,1,3,3-tetramethylurea;urea
CID 158796669
carbamic acid;N,N-dimethylmethanamine
CID 173358065
1,1-diamino-3,3-dimethylurea
CID 154021119
N-carbamoyl-N,3-dimethylbutanamide
CID 121479139
(2S)-2-amino-N-carbamoyl-N,3,3-trimethylbutanamide
CID 87212961
azane;urea
CID 158949980
1-ethyl-1-methylurea
CID 3032104
amino N-amino-N-methylcarbamate
CID 174563517
1-methyl-1-phosphorosourea
CID 152798970

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-carbamoyl-1,3-dimethylurea?
The IUPAC name of 1-amino-3-carbamoyl-1,3-dimethylurea (CID 89086493) is 1-amino-3-carbamoyl-1,3-dimethylurea.
What is the SMILES notation for 1-amino-3-carbamoyl-1,3-dimethylurea?
The canonical SMILES for 1-amino-3-carbamoyl-1,3-dimethylurea is CN(N)C(=O)N(C)C(N)=O.
What is the InChIKey of 1-amino-3-carbamoyl-1,3-dimethylurea?
The InChIKey is UDDZPJJOQVYYSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N4O2/c1-7(3(5)9)4(10)8(2)6/h6H2,1-2H3,(H2,5,9).
What are the key properties of 1-amino-3-carbamoyl-1,3-dimethylurea?
1-amino-3-carbamoyl-1,3-dimethylurea has a molecular weight of 146.15 g/mol, XLogP of -1.08, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-carbamoyl-1,3-dimethylurea is sourced from PubChem (CID 89086493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).