6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one

C8H14N2O — CID 155707564

IUPAC6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one
SMILESCC1C=CN(C(C)C)C(=O)N1
InChIInChI=1S/C8H14N2O/c1-6(2)10-5-4-7(3)9-8(10)11/h4-7H,1-3H3,(H,9,11)
InChIKeyCZUWVWRYIUOAAA-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.32
Rot. Bonds1

About 6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one

6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one (PubChem CID 155707564) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one.

Molecular Properties

Compound Name6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one
PubChem CID155707564
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one
SMILESCC1C=CN(C(C)C)C(=O)N1
InChIInChI=1S/C8H14N2O/c1-6(2)10-5-4-7(3)9-8(10)11/h4-7H,1-3H3,(H,9,11)
InChIKeyCZUWVWRYIUOAAA-UHFFFAOYSA-N
XLogP1.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,3-Dimethylcytosine
CID 15895115
3,4-Di-hydro-4-methyl-2(1H)-pyrimidinon
CID 14689526
4-Amino-4-methyl-3,4-dihydropyrimidin-2(1H)-one
CID 22987932
N-methyldihydro-2-pyrimidinone
CID 23121765
4-Amino-3-methyl-1,4-dihydropyrimidin-2-one
CID 55289347
4-Amino-3-ethyl-1,4-dihydropyrimidin-2-one
CID 55291156
Ethyl 3,4-dihydropyrimidinone
CID 67592206
5-Fluoro-6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one
CID 89965635
1,4-Dimethylcytosine
CID 129701698
1,3,4-trimethyl-4H-pyrimidin-2-one
CID 89913
N-ethyl-4H-pyridine-1-carboxamide
CID 20063789
N-propan-2-yl-2H-pyridine-1-carboxamide
CID 21842485

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one?
The IUPAC name of 6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one (CID 155707564) is 6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one.
What is the SMILES notation for 6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one?
The canonical SMILES for 6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one is CC1C=CN(C(C)C)C(=O)N1.
What is the InChIKey of 6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one?
The InChIKey is CZUWVWRYIUOAAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-6(2)10-5-4-7(3)9-8(10)11/h4-7H,1-3H3,(H,9,11).
What are the key properties of 6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one?
6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one has a molecular weight of 154.21 g/mol, XLogP of 1.32, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-propan-2-yl-1,6-dihydropyrimidin-2-one is sourced from PubChem (CID 155707564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).