N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide

C10H15N3O — CID 91540059

IUPACN-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide
SMILESCc1ncnc(NC(=O)C(C)C)c1C
InChIInChI=1S/C10H15N3O/c1-6(2)10(14)13-9-7(3)8(4)11-5-12-9/h5-6H,1-4H3,(H,11,12,13,14)
InChIKeyZZXTUVXWDHXORH-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.69
Rot. Bonds2

About N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide

N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide (PubChem CID 91540059) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide
PubChem CID91540059
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC NameN-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide
SMILESCc1ncnc(NC(=O)C(C)C)c1C
InChIInChI=1S/C10H15N3O/c1-6(2)10(14)13-9-7(3)8(4)11-5-12-9/h5-6H,1-4H3,(H,11,12,13,14)
InChIKeyZZXTUVXWDHXORH-UHFFFAOYSA-N
XLogP1.69
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide?
The IUPAC name of N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide (CID 91540059) is N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide.
What is the SMILES notation for N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide?
The canonical SMILES for N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide is Cc1ncnc(NC(=O)C(C)C)c1C.
What is the InChIKey of N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide?
The InChIKey is ZZXTUVXWDHXORH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-6(2)10(14)13-9-7(3)8(4)11-5-12-9/h5-6H,1-4H3,(H,11,12,13,14).
What are the key properties of N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide?
N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide has a molecular weight of 193.25 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-dimethylpyrimidin-4-yl)-2-methylpropanamide is sourced from PubChem (CID 91540059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).