5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide

C7H9N3O2 — CID 91460535

IUPAC5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide
SMILESCN(C)C(=O)c1ncncc1O
InChIInChI=1S/C7H9N3O2/c1-10(2)7(12)6-5(11)3-8-4-9-6/h3-4,11H,1-2H3
InChIKeyNYYGWVIAZCMCCS-UHFFFAOYSA-N
MW167.17 g/mol
LogP-0.12
Rot. Bonds1

About 5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide

5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide (PubChem CID 91460535) has the molecular formula C7H9N3O2 and a molecular weight of 167.17 g/mol. Its IUPAC name is 5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide
PubChem CID91460535
Molecular FormulaC7H9N3O2
Molecular Weight167.17 g/mol
Exact Mass167.07
IUPAC Name5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide
SMILESCN(C)C(=O)c1ncncc1O
InChIInChI=1S/C7H9N3O2/c1-10(2)7(12)6-5(11)3-8-4-9-6/h3-4,11H,1-2H3
InChIKeyNYYGWVIAZCMCCS-UHFFFAOYSA-N
XLogP-0.12
TPSA66.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide?
The IUPAC name of 5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide (CID 91460535) is 5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide.
What is the SMILES notation for 5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide?
The canonical SMILES for 5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide is CN(C)C(=O)c1ncncc1O.
What is the InChIKey of 5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide?
The InChIKey is NYYGWVIAZCMCCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O2/c1-10(2)7(12)6-5(11)3-8-4-9-6/h3-4,11H,1-2H3.
What are the key properties of 5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide?
5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide has a molecular weight of 167.17 g/mol, XLogP of -0.12, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N,N-dimethylpyrimidine-4-carboxamide is sourced from PubChem (CID 91460535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).