[[(2R)-2-amino-1-oxopropan-2-yl]amino]urea

C4H10N4O2 — CID 57321142

IUPAC[[(2R)-2-amino-1-oxopropan-2-yl]amino]urea
SMILESC[C@](N)(C=O)NNC(N)=O
InChIInChI=1S/C4H10N4O2/c1-4(6,2-9)8-7-3(5)10/h2,8H,6H2,1H3,(H3,5,7,10)/t4-/m1/s1
InChIKeyAYWPKBSLULSEKD-SCSAIBSYSA-N
MW146.15 g/mol
LogP-1.97
Rot. Bonds3

About [[(2R)-2-amino-1-oxopropan-2-yl]amino]urea

[[(2R)-2-amino-1-oxopropan-2-yl]amino]urea (PubChem CID 57321142) has the molecular formula C4H10N4O2 and a molecular weight of 146.15 g/mol. Its IUPAC name is [[(2R)-2-amino-1-oxopropan-2-yl]amino]urea.

Molecular Properties

Compound Name[[(2R)-2-amino-1-oxopropan-2-yl]amino]urea
PubChem CID57321142
Molecular FormulaC4H10N4O2
Molecular Weight146.15 g/mol
Exact Mass146.08
IUPAC Name[[(2R)-2-amino-1-oxopropan-2-yl]amino]urea
SMILESC[C@](N)(C=O)NNC(N)=O
InChIInChI=1S/C4H10N4O2/c1-4(6,2-9)8-7-3(5)10/h2,8H,6H2,1H3,(H3,5,7,10)/t4-/m1/s1
InChIKeyAYWPKBSLULSEKD-SCSAIBSYSA-N
XLogP-1.97
TPSA110.24 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 5-1.97
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [[(2R)-2-amino-1-oxopropan-2-yl]amino]urea?
The IUPAC name of [[(2R)-2-amino-1-oxopropan-2-yl]amino]urea (CID 57321142) is [[(2R)-2-amino-1-oxopropan-2-yl]amino]urea.
What is the SMILES notation for [[(2R)-2-amino-1-oxopropan-2-yl]amino]urea?
The canonical SMILES for [[(2R)-2-amino-1-oxopropan-2-yl]amino]urea is C[C@](N)(C=O)NNC(N)=O.
What is the InChIKey of [[(2R)-2-amino-1-oxopropan-2-yl]amino]urea?
The InChIKey is AYWPKBSLULSEKD-SCSAIBSYSA-N. The full InChI is InChI=1S/C4H10N4O2/c1-4(6,2-9)8-7-3(5)10/h2,8H,6H2,1H3,(H3,5,7,10)/t4-/m1/s1.
What are the key properties of [[(2R)-2-amino-1-oxopropan-2-yl]amino]urea?
[[(2R)-2-amino-1-oxopropan-2-yl]amino]urea has a molecular weight of 146.15 g/mol, XLogP of -1.97, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [[(2R)-2-amino-1-oxopropan-2-yl]amino]urea is sourced from PubChem (CID 57321142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).