2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide

C10H15N3O2 — CID 137179767

IUPAC2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide
SMILESCc1cc(=O)[nH]c(CNC(=O)C(C)C)n1
InChIInChI=1S/C10H15N3O2/c1-6(2)10(15)11-5-8-12-7(3)4-9(14)13-8/h4,6H,5H2,1-3H3,(H,11,15)(H,12,13,14)
InChIKeyKXHHAPGNQUWSRV-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.35
Rot. Bonds3

About 2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide

2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide (PubChem CID 137179767) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide
PubChem CID137179767
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide
SMILESCc1cc(=O)[nH]c(CNC(=O)C(C)C)n1
InChIInChI=1S/C10H15N3O2/c1-6(2)10(15)11-5-8-12-7(3)4-9(14)13-8/h4,6H,5H2,1-3H3,(H,11,15)(H,12,13,14)
InChIKeyKXHHAPGNQUWSRV-UHFFFAOYSA-N
XLogP0.35
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(Diethylaminomethyl)-4-hydroxy-2-methylpyrimidine
CID 135508651
2-(Aminomethyl)-6-methylpyrimidin-4(3H)-one
CID 135714975
2-(Aminomethyl)-6-methyl-3,4-dihydropyrimidin-4-one dihydrochloride
CID 137098529
N-(2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)isobutyramide
CID 18566117
N-((6-Methyl-4-oxo-1,4-dihydropyrimidin-2-yl)methyl)acetamide
CID 136208150
N-(1-(6-Methyl-4-oxo-1,4-dihydropyrimidin-2-yl)ethyl)acetamide
CID 136245430
N~2~,N~2~-diethyl-N~1~-[(6-hydroxy-2-methylpyrimidin-4-yl)methyl]glycinamide
CID 136663687
4-(diethylaminomethyl)-2-propan-2-yl-1H-pyrimidin-6-one;hydrochloride
CID 157847969
2-methyl-N-[1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]propanamide
CID 137301596
N-[3-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)butyl]acetamide
CID 137301598
2-methyl-N-[3-methyl-1-(4-methyl-6-oxo-1H-pyrimidin-2-yl)butyl]propanamide
CID 137316163
2,6-Dimethyl-3-[2-(2,2,2-trifluoroethylamino)ethyl]pyrimidin-4-one
CID 63794380

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide?
The IUPAC name of 2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide (CID 137179767) is 2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide.
What is the SMILES notation for 2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide?
The canonical SMILES for 2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide is Cc1cc(=O)[nH]c(CNC(=O)C(C)C)n1.
What is the InChIKey of 2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide?
The InChIKey is KXHHAPGNQUWSRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-6(2)10(15)11-5-8-12-7(3)4-9(14)13-8/h4,6H,5H2,1-3H3,(H,11,15)(H,12,13,14).
What are the key properties of 2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide?
2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide has a molecular weight of 209.25 g/mol, XLogP of 0.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)methyl]propanamide is sourced from PubChem (CID 137179767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).