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

C10H15N3O2 — CID 137047230

IUPACN-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide
SMILESCc1nc(NC(=O)C(C)C)[nH]c(=O)c1C
InChIInChI=1S/C10H15N3O2/c1-5(2)8(14)12-10-11-7(4)6(3)9(15)13-10/h5H,1-4H3,(H2,11,12,13,14,15)
InChIKeyQSVHBWQGSFUGCA-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.98
Rot. Bonds2

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

N-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide (PubChem CID 137047230) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is N-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide
PubChem CID137047230
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC NameN-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide
SMILESCc1nc(NC(=O)C(C)C)[nH]c(=O)c1C
InChIInChI=1S/C10H15N3O2/c1-5(2)8(14)12-10-11-7(4)6(3)9(15)13-10/h5H,1-4H3,(H2,11,12,13,14,15)
InChIKeyQSVHBWQGSFUGCA-UHFFFAOYSA-N
XLogP0.98
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide?
The IUPAC name of N-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide (CID 137047230) is N-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide.
What is the SMILES notation for N-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide?
The canonical SMILES for N-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide is Cc1nc(NC(=O)C(C)C)[nH]c(=O)c1C.
What is the InChIKey of N-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide?
The InChIKey is QSVHBWQGSFUGCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-5(2)8(14)12-10-11-7(4)6(3)9(15)13-10/h5H,1-4H3,(H2,11,12,13,14,15).
What are the key properties of N-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide?
N-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide has a molecular weight of 209.25 g/mol, XLogP of 0.98, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,5-dimethyl-6-oxo-1H-pyrimidin-2-yl)-2-methylpropanamide is sourced from PubChem (CID 137047230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).