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

C10H18N4O3 — CID 144810688

IUPAC4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine
SMILESCNC.CNC(=O)c1c(OC)ncnc1OC
InChIInChI=1S/C8H11N3O3.C2H7N/c1-9-6(12)5-7(13-2)10-4-11-8(5)14-3;1-3-2/h4H,1-3H3,(H,9,12);3H,1-2H3
InChIKeyVHFJFPZRQOQZFI-UHFFFAOYSA-N
MW242.28 g/mol
LogP-0.31
Rot. Bonds3

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

4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine (PubChem CID 144810688) has the molecular formula C10H18N4O3 and a molecular weight of 242.28 g/mol. Its IUPAC name is 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine.

Molecular Properties

Compound Name4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine
PubChem CID144810688
Molecular FormulaC10H18N4O3
Molecular Weight242.28 g/mol
Exact Mass242.14
IUPAC Name4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine
SMILESCNC.CNC(=O)c1c(OC)ncnc1OC
InChIInChI=1S/C8H11N3O3.C2H7N/c1-9-6(12)5-7(13-2)10-4-11-8(5)14-3;1-3-2/h4H,1-3H3,(H,9,12);3H,1-2H3
InChIKeyVHFJFPZRQOQZFI-UHFFFAOYSA-N
XLogP-0.31
TPSA85.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-Pyrimidinecarboxamide, 2-amino-N-(2-(diethylamino)ethyl)-4-methoxy-
CID 3055434
5-Pyrimidinecarboxamide, 2-amino-N-[2-(dimethylamino)ethyl]-4-methoxy-
CID 3069098
5-Pyrimidinecarboxamide, 2-amino-N-(3-(dimethylamino)propyl)-4-methoxy-
CID 3069100
5-Pyrimidinecarboxamide, 2-amino-N-(3-(diethylamino)propyl)-4-methoxy-
CID 3069101
4,6-Dimethoxypyrimidine-5-carbaldehyde
CID 4436645
4,6-Dimethoxypyrimidine-5-carboxylic acid
CID 19070667
4-Amino-6-methoxypyrimidine-5-carbaldehyde
CID 71695332
4-(difluoromethoxy)-6-methoxy-N-methylpyrimidine-5-carboxamide
CID 171547804
2-Amino-4,6-dimethoxy-5-formylpyrimidin
CID 11701146
N-(3-amino-2,2-difluoropropyl)-4,6-dimethoxypyrimidine-5-carboxamide;hydrochloride
CID 120411200
N-(3-amino-2,2-difluoropropyl)-4,6-dimethoxypyrimidine-5-carboxamide
CID 120411201
4,6-dimethoxy-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)pyrimidine-5-carboxamide;hydrochloride
CID 120811102

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine?
The IUPAC name of 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine (CID 144810688) is 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine.
What is the SMILES notation for 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine?
The canonical SMILES for 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine is CNC.CNC(=O)c1c(OC)ncnc1OC.
What is the InChIKey of 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine?
The InChIKey is VHFJFPZRQOQZFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3.C2H7N/c1-9-6(12)5-7(13-2)10-4-11-8(5)14-3;1-3-2/h4H,1-3H3,(H,9,12);3H,1-2H3.
What are the key properties of 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine?
4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine has a molecular weight of 242.28 g/mol, XLogP of -0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxy-N-methylpyrimidine-5-carboxamide;N-methylmethanamine is sourced from PubChem (CID 144810688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).