(4-methyl-6-oxo-1H-pyrimidin-2-yl)urea

C6H8N4O2 — CID 135408702

IUPAC(4-methyl-6-oxo-1H-pyrimidin-2-yl)urea
SMILESCc1cc(=O)[nH]c(NC(N)=O)n1
InChIInChI=1S/C6H8N4O2/c1-3-2-4(11)9-6(8-3)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)
InChIKeyGWBGGJASGYDQMF-UHFFFAOYSA-N
MW168.16 g/mol
LogP-0.43
Rot. Bonds1

About (4-methyl-6-oxo-1H-pyrimidin-2-yl)urea

(4-methyl-6-oxo-1H-pyrimidin-2-yl)urea (PubChem CID 135408702) has the molecular formula C6H8N4O2 and a molecular weight of 168.16 g/mol. Its IUPAC name is (4-methyl-6-oxo-1H-pyrimidin-2-yl)urea.

Molecular Properties

Compound Name(4-methyl-6-oxo-1H-pyrimidin-2-yl)urea
PubChem CID135408702
Molecular FormulaC6H8N4O2
Molecular Weight168.16 g/mol
Exact Mass168.06
IUPAC Name(4-methyl-6-oxo-1H-pyrimidin-2-yl)urea
SMILESCc1cc(=O)[nH]c(NC(N)=O)n1
InChIInChI=1S/C6H8N4O2/c1-3-2-4(11)9-6(8-3)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12)
InChIKeyGWBGGJASGYDQMF-UHFFFAOYSA-N
XLogP-0.43
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.16
LogP ≤ 5-0.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (4-methyl-6-oxo-1H-pyrimidin-2-yl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(diethylamino)-6-methyl-1H-pyrimidin-4-one
CID 135448147
2-Amino-6-methylpyrimidin-4-one
CID 135402055
2-Cyanoamino-4-Hydroxy-6-Methylpyrimidine
CID 135454173
2-Hydrazinyl-6-methylpyrimidin-4-ol
CID 135399119
2-Methoxy-6-methyl-3,4-dihydropyrimidin-4-one
CID 135437273
2,6-diaminopyrimidin-4(3H)-one monohydrate
CID 135898821
2-amino-4-(2-amino-6-oxo-1H-pyrimidin-4-yl)-1H-pyrimidin-6-one
CID 155565016
N-(4-hydroxy-6-methylpyrimidin-2-yl)acetamide
CID 135455254
2-Ethyl-1-(4-hydroxy-6-methyl-2-pyrimidinyl)isourea
CID 135679882
Urea, (1,4-dihydro-4-oxo-6-(trifluoromethyl)-2-pyrimidinyl)-
CID 135446460
N,N-Dimethyl-N''-(6-methyl-4-oxo-1,4-dihydropyrimidin-2-yl)guanidine
CID 135488785
2-Amino-6-(fluoromethyl)pyrimidin-4(1h)-one
CID 135527970

Frequently Asked Questions

What is the IUPAC name of (4-methyl-6-oxo-1H-pyrimidin-2-yl)urea?
The IUPAC name of (4-methyl-6-oxo-1H-pyrimidin-2-yl)urea (CID 135408702) is (4-methyl-6-oxo-1H-pyrimidin-2-yl)urea.
What is the SMILES notation for (4-methyl-6-oxo-1H-pyrimidin-2-yl)urea?
The canonical SMILES for (4-methyl-6-oxo-1H-pyrimidin-2-yl)urea is Cc1cc(=O)[nH]c(NC(N)=O)n1.
What is the InChIKey of (4-methyl-6-oxo-1H-pyrimidin-2-yl)urea?
The InChIKey is GWBGGJASGYDQMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O2/c1-3-2-4(11)9-6(8-3)10-5(7)12/h2H,1H3,(H4,7,8,9,10,11,12).
What are the key properties of (4-methyl-6-oxo-1H-pyrimidin-2-yl)urea?
(4-methyl-6-oxo-1H-pyrimidin-2-yl)urea has a molecular weight of 168.16 g/mol, XLogP of -0.43, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-6-oxo-1H-pyrimidin-2-yl)urea is sourced from PubChem (CID 135408702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).