1-phenyl-1-(1H-triazin-2-yl)urea

C10H11N5O — CID 67443765

IUPAC1-phenyl-1-(1H-triazin-2-yl)urea
SMILESNC(=O)N(c1ccccc1)N1N=CC=CN1
InChIInChI=1S/C10H11N5O/c11-10(16)14(9-5-2-1-3-6-9)15-12-7-4-8-13-15/h1-8,12H,(H2,11,16)
InChIKeyKWGOQPQSLAHZCO-UHFFFAOYSA-N
MW217.23 g/mol
LogP0.81
Rot. Bonds2

About 1-phenyl-1-(1H-triazin-2-yl)urea

1-phenyl-1-(1H-triazin-2-yl)urea (PubChem CID 67443765) has the molecular formula C10H11N5O and a molecular weight of 217.23 g/mol. Its IUPAC name is 1-phenyl-1-(1H-triazin-2-yl)urea.

Molecular Properties

Compound Name1-phenyl-1-(1H-triazin-2-yl)urea
PubChem CID67443765
Molecular FormulaC10H11N5O
Molecular Weight217.23 g/mol
Exact Mass217.10
IUPAC Name1-phenyl-1-(1H-triazin-2-yl)urea
SMILESNC(=O)N(c1ccccc1)N1N=CC=CN1
InChIInChI=1S/C10H11N5O/c11-10(16)14(9-5-2-1-3-6-9)15-12-7-4-8-13-15/h1-8,12H,(H2,11,16)
InChIKeyKWGOQPQSLAHZCO-UHFFFAOYSA-N
XLogP0.81
TPSA73.96 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-phenyl-1-(triazol-1-yl)urea
CID 23325971
1,1-diphenylurea
CID 174849888
2-phenyl-2-(1H-triazin-2-ylsulfanyl)acetamide
CID 87343906
1-(N-carbamoylanilino)indole-2-carboxylic acid
CID 67622156
1-methylsulfonyl-1-phenylurea
CID 67458693
butane;1,1-diphenylurea
CID 70397101
1-phenyl-1-(4-phenylphenyl)urea
CID 90698606
1-methoxy-1-phenylurea
CID 15620442
1-(4-hydroxy-2-sulfanylidene-1,3-thiazol-3-yl)-1-phenylurea
CID 91046069
1-indol-1-yl-1-pyridin-4-ylurea
CID 174592326
1-methyl-1-(N-methylanilino)urea
CID 154254582
carbamic acid;naphthalene
CID 162082147

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-1-(1H-triazin-2-yl)urea?
The IUPAC name of 1-phenyl-1-(1H-triazin-2-yl)urea (CID 67443765) is 1-phenyl-1-(1H-triazin-2-yl)urea.
What is the SMILES notation for 1-phenyl-1-(1H-triazin-2-yl)urea?
The canonical SMILES for 1-phenyl-1-(1H-triazin-2-yl)urea is NC(=O)N(c1ccccc1)N1N=CC=CN1.
What is the InChIKey of 1-phenyl-1-(1H-triazin-2-yl)urea?
The InChIKey is KWGOQPQSLAHZCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O/c11-10(16)14(9-5-2-1-3-6-9)15-12-7-4-8-13-15/h1-8,12H,(H2,11,16).
What are the key properties of 1-phenyl-1-(1H-triazin-2-yl)urea?
1-phenyl-1-(1H-triazin-2-yl)urea has a molecular weight of 217.23 g/mol, XLogP of 0.81, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-1-(1H-triazin-2-yl)urea is sourced from PubChem (CID 67443765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).