4,5-dihydro-1H-imidazol-2-ylmethylurea

C5H10N4O — CID 57073785

IUPAC4,5-dihydro-1H-imidazol-2-ylmethylurea
SMILESNC(=O)NCC1=NCCN1
InChIInChI=1S/C5H10N4O/c6-5(10)9-3-4-7-1-2-8-4/h1-3H2,(H,7,8)(H3,6,9,10)
InChIKeyFQTRYLDKAFGQSF-UHFFFAOYSA-N
MW142.16 g/mol
LogP-1.34
Rot. Bonds2

About 4,5-dihydro-1H-imidazol-2-ylmethylurea

4,5-dihydro-1H-imidazol-2-ylmethylurea (PubChem CID 57073785) has the molecular formula C5H10N4O and a molecular weight of 142.16 g/mol. Its IUPAC name is 4,5-dihydro-1H-imidazol-2-ylmethylurea.

Molecular Properties

Compound Name4,5-dihydro-1H-imidazol-2-ylmethylurea
PubChem CID57073785
Molecular FormulaC5H10N4O
Molecular Weight142.16 g/mol
Exact Mass142.09
IUPAC Name4,5-dihydro-1H-imidazol-2-ylmethylurea
SMILESNC(=O)NCC1=NCCN1
InChIInChI=1S/C5H10N4O/c6-5(10)9-3-4-7-1-2-8-4/h1-3H2,(H,7,8)(H3,6,9,10)
InChIKeyFQTRYLDKAFGQSF-UHFFFAOYSA-N
XLogP-1.34
TPSA79.51 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-1.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,5-dihydro-1H-imidazol-2-ylmethylurea?
The IUPAC name of 4,5-dihydro-1H-imidazol-2-ylmethylurea (CID 57073785) is 4,5-dihydro-1H-imidazol-2-ylmethylurea.
What is the SMILES notation for 4,5-dihydro-1H-imidazol-2-ylmethylurea?
The canonical SMILES for 4,5-dihydro-1H-imidazol-2-ylmethylurea is NC(=O)NCC1=NCCN1.
What is the InChIKey of 4,5-dihydro-1H-imidazol-2-ylmethylurea?
The InChIKey is FQTRYLDKAFGQSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4O/c6-5(10)9-3-4-7-1-2-8-4/h1-3H2,(H,7,8)(H3,6,9,10).
What are the key properties of 4,5-dihydro-1H-imidazol-2-ylmethylurea?
4,5-dihydro-1H-imidazol-2-ylmethylurea has a molecular weight of 142.16 g/mol, XLogP of -1.34, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dihydro-1H-imidazol-2-ylmethylurea is sourced from PubChem (CID 57073785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).