(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea

C7H10N4O2 — CID 137273919

IUPAC(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea
SMILESCc1nc(NC(N)=O)[nH]c(=O)c1C
InChIInChI=1S/C7H10N4O2/c1-3-4(2)9-7(10-5(3)12)11-6(8)13/h1-2H3,(H4,8,9,10,11,12,13)
InChIKeyYVNNEXPBHOOQQT-UHFFFAOYSA-N
MW182.18 g/mol
LogP-0.12
Rot. Bonds1

About (4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea

(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea (PubChem CID 137273919) has the molecular formula C7H10N4O2 and a molecular weight of 182.18 g/mol. Its IUPAC name is (4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea.

Molecular Properties

Compound Name(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea
PubChem CID137273919
Molecular FormulaC7H10N4O2
Molecular Weight182.18 g/mol
Exact Mass182.08
IUPAC Name(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea
SMILESCc1nc(NC(N)=O)[nH]c(=O)c1C
InChIInChI=1S/C7H10N4O2/c1-3-4(2)9-7(10-5(3)12)11-6(8)13/h1-2H3,(H4,8,9,10,11,12,13)
InChIKeyYVNNEXPBHOOQQT-UHFFFAOYSA-N
XLogP-0.12
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 5-0.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4,5-dimethyl-2-(methylamino)-1H-pyrimidin-6-one
CID 135401759
5,6-Dimethylisocytosine
CID 135402388
Pirimicarb-desamido
CID 135420611
2-Amino-3,5,6-trimethylpyrimidin-4-one
CID 2822937
2-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-1,1-dimethylguanidine
CID 135845994
2-Amino-6-methyl-5-(trifluoromethyl)-4(3H)-pyrimidinone
CID 135955182
2,6-Diamino-5-methylpyrimidin-4(1H)-one
CID 135413061
2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-1,1-dimethyl-guanidine
CID 135428300
5,6-Dimethyl-4-hydroxy-2-methoxypyrimidine
CID 135803836
2-(Ethylamino)-5,6-dimethyl-4(3H)-pyrimidinone
CID 135581387
2-Amino-5-methyl-6-(trifluoromethyl)pyrimidin-4(3H)-one
CID 136197502
2-Amino-6-ethyl-5-methylpyrimidin-4-ol
CID 135431426

Frequently Asked Questions

What is the IUPAC name of (4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea?
The IUPAC name of (4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea (CID 137273919) is (4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea.
What is the SMILES notation for (4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea?
The canonical SMILES for (4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea is Cc1nc(NC(N)=O)[nH]c(=O)c1C.
What is the InChIKey of (4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea?
The InChIKey is YVNNEXPBHOOQQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O2/c1-3-4(2)9-7(10-5(3)12)11-6(8)13/h1-2H3,(H4,8,9,10,11,12,13).
What are the key properties of (4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea?
(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea has a molecular weight of 182.18 g/mol, XLogP of -0.12, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)urea is sourced from PubChem (CID 137273919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).