4,6-dimethoxy-N-methylpyrimidine-5-carboxamide

C8H11N3O3 — CID 144810689

IUPAC4,6-dimethoxy-N-methylpyrimidine-5-carboxamide
SMILESCNC(=O)c1c(OC)ncnc1OC
InChIInChI=1S/C8H11N3O3/c1-9-6(12)5-7(13-2)10-4-11-8(5)14-3/h4H,1-3H3,(H,9,12)
InChIKeyJAWZWZQFWQSQKF-UHFFFAOYSA-N
MW197.19 g/mol
LogP-0.15
Rot. Bonds3

About 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide

4,6-dimethoxy-N-methylpyrimidine-5-carboxamide (PubChem CID 144810689) has the molecular formula C8H11N3O3 and a molecular weight of 197.19 g/mol. Its IUPAC name is 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide.

Molecular Properties

Compound Name4,6-dimethoxy-N-methylpyrimidine-5-carboxamide
PubChem CID144810689
Molecular FormulaC8H11N3O3
Molecular Weight197.19 g/mol
Exact Mass197.08
IUPAC Name4,6-dimethoxy-N-methylpyrimidine-5-carboxamide
SMILESCNC(=O)c1c(OC)ncnc1OC
InChIInChI=1S/C8H11N3O3/c1-9-6(12)5-7(13-2)10-4-11-8(5)14-3/h4H,1-3H3,(H,9,12)
InChIKeyJAWZWZQFWQSQKF-UHFFFAOYSA-N
XLogP-0.15
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.19
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide?
The IUPAC name of 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide (CID 144810689) is 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide.
What is the SMILES notation for 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide?
The canonical SMILES for 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide is CNC(=O)c1c(OC)ncnc1OC.
What is the InChIKey of 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide?
The InChIKey is JAWZWZQFWQSQKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3/c1-9-6(12)5-7(13-2)10-4-11-8(5)14-3/h4H,1-3H3,(H,9,12).
What are the key properties of 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide?
4,6-dimethoxy-N-methylpyrimidine-5-carboxamide has a molecular weight of 197.19 g/mol, XLogP of -0.15, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide is sourced from PubChem (CID 144810689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).