N,4-dimethylpyrimidine-2-carboxamide

C7H9N3O — CID 127011220

IUPACN,4-dimethylpyrimidine-2-carboxamide
SMILESCNC(=O)c1nccc(C)n1
InChIInChI=1S/C7H9N3O/c1-5-3-4-9-6(10-5)7(11)8-2/h3-4H,1-2H3,(H,8,11)
InChIKeyXTPZUERUFFBLLT-UHFFFAOYSA-N
MW151.17 g/mol
LogP0.14
Rot. Bonds1

About N,4-dimethylpyrimidine-2-carboxamide

N,4-dimethylpyrimidine-2-carboxamide (PubChem CID 127011220) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is N,4-dimethylpyrimidine-2-carboxamide.

Molecular Properties

Compound NameN,4-dimethylpyrimidine-2-carboxamide
PubChem CID127011220
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC NameN,4-dimethylpyrimidine-2-carboxamide
SMILESCNC(=O)c1nccc(C)n1
InChIInChI=1S/C7H9N3O/c1-5-3-4-9-6(10-5)7(11)8-2/h3-4H,1-2H3,(H,8,11)
InChIKeyXTPZUERUFFBLLT-UHFFFAOYSA-N
XLogP0.14
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,4-dimethylpyrimidine-2-carboxamide?
The IUPAC name of N,4-dimethylpyrimidine-2-carboxamide (CID 127011220) is N,4-dimethylpyrimidine-2-carboxamide.
What is the SMILES notation for N,4-dimethylpyrimidine-2-carboxamide?
The canonical SMILES for N,4-dimethylpyrimidine-2-carboxamide is CNC(=O)c1nccc(C)n1.
What is the InChIKey of N,4-dimethylpyrimidine-2-carboxamide?
The InChIKey is XTPZUERUFFBLLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c1-5-3-4-9-6(10-5)7(11)8-2/h3-4H,1-2H3,(H,8,11).
What are the key properties of N,4-dimethylpyrimidine-2-carboxamide?
N,4-dimethylpyrimidine-2-carboxamide has a molecular weight of 151.17 g/mol, XLogP of 0.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethylpyrimidine-2-carboxamide is sourced from PubChem (CID 127011220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).