1-carbamoyl-3-(dihydroxyamino)urea

C2H6N4O4 — CID 3930640

IUPAC1-carbamoyl-3-(dihydroxyamino)urea
SMILESNC(=O)NC(=O)NN(O)O
InChIInChI=1S/C2H6N4O4/c3-1(7)4-2(8)5-6(9)10/h9-10H,(H4,3,4,5,7,8)
InChIKeyOYDHGCYMTXFIOP-UHFFFAOYSA-N
MW150.09 g/mol
LogP-1.64
Rot. Bonds1

About 1-carbamoyl-3-(dihydroxyamino)urea

1-carbamoyl-3-(dihydroxyamino)urea (PubChem CID 3930640) has the molecular formula C2H6N4O4 and a molecular weight of 150.09 g/mol. Its IUPAC name is 1-carbamoyl-3-(dihydroxyamino)urea.

Molecular Properties

Compound Name1-carbamoyl-3-(dihydroxyamino)urea
PubChem CID3930640
Molecular FormulaC2H6N4O4
Molecular Weight150.09 g/mol
Exact Mass150.04
IUPAC Name1-carbamoyl-3-(dihydroxyamino)urea
SMILESNC(=O)NC(=O)NN(O)O
InChIInChI=1S/C2H6N4O4/c3-1(7)4-2(8)5-6(9)10/h9-10H,(H4,3,4,5,7,8)
InChIKeyOYDHGCYMTXFIOP-UHFFFAOYSA-N
XLogP-1.64
TPSA127.92 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.09
LogP ≤ 5-1.64
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-carbamothioyl-3-carbamoylurea
CID 57033303
N-(carbamoylcarbamoyl)carbamoyl fluoride
CID 22166147
1-aminosulfanyl-3-carbamoylurea
CID 87475269
sodium;1-bromo-3-carbamoylurea;hydride
CID 174408388
CID 118590953
CID 118590953
carbamoylurea;copper;thiourea
CID 175029091
carbamoylcarbamic acid;carbamoylurea
CID 15920414
carbamoylurea;fluoroform
CID 174631914
O-amino N-carbamoylcarbamothioate
CID 54398285
N-carbamoylcarbamoyl chloride;carbamoyl chloride
CID 170170459
CID 174966153
CID 174966153
CID 174050071
CID 174050071

Frequently Asked Questions

What is the IUPAC name of 1-carbamoyl-3-(dihydroxyamino)urea?
The IUPAC name of 1-carbamoyl-3-(dihydroxyamino)urea (CID 3930640) is 1-carbamoyl-3-(dihydroxyamino)urea.
What is the SMILES notation for 1-carbamoyl-3-(dihydroxyamino)urea?
The canonical SMILES for 1-carbamoyl-3-(dihydroxyamino)urea is NC(=O)NC(=O)NN(O)O.
What is the InChIKey of 1-carbamoyl-3-(dihydroxyamino)urea?
The InChIKey is OYDHGCYMTXFIOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6N4O4/c3-1(7)4-2(8)5-6(9)10/h9-10H,(H4,3,4,5,7,8).
What are the key properties of 1-carbamoyl-3-(dihydroxyamino)urea?
1-carbamoyl-3-(dihydroxyamino)urea has a molecular weight of 150.09 g/mol, XLogP of -1.64, 1 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-carbamoyl-3-(dihydroxyamino)urea is sourced from PubChem (CID 3930640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).