4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine

C8H13N3O2 — CID 838369

IUPAC4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine
SMILESCOc1cc(OC)nc(N(C)C)n1
InChIInChI=1S/C8H13N3O2/c1-11(2)8-9-6(12-3)5-7(10-8)13-4/h5H,1-4H3
InChIKeyLQJYTNBYICJMDK-UHFFFAOYSA-N
MW183.21 g/mol
LogP0.56
Rot. Bonds3

About 4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine

4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine (PubChem CID 838369) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine.

Molecular Properties

Compound Name4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine
PubChem CID838369
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine
SMILESCOc1cc(OC)nc(N(C)C)n1
InChIInChI=1S/C8H13N3O2/c1-11(2)8-9-6(12-3)5-7(10-8)13-4/h5H,1-4H3
InChIKeyLQJYTNBYICJMDK-UHFFFAOYSA-N
XLogP0.56
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 50.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-Amino-4,6-dimethoxypyrimidine
CID 118946
2,6-Dimethoxy-4-aminopyrimidine
CID 76789
4,6-Dimethoxy-2-pyrimidinyl urea
CID 9837373
2,4-Dimethoxypyrimidine
CID 137976
4-Chloro-2,6-dimethoxypyrimidine
CID 80600
4-Amino-6-methoxypyrimidine
CID 735731
N-(4,6-dimethoxypyrimidin-2-yl)acetamide
CID 934943
2,4,6-Trimethoxypyrimidine
CID 726938
2-Chloro-4,6-dimethoxypyrimidine
CID 5152323
N-(4,6-dimethoxypyrimidin-2-yl)-2-methylpropanamide
CID 718572
4,6-Dimethoxypyrimidine-2-carbonitrile
CID 21466113
2,4-Diamino-6-methoxypyrimidine
CID 816925

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine?
The IUPAC name of 4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine (CID 838369) is 4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine.
What is the SMILES notation for 4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine?
The canonical SMILES for 4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine is COc1cc(OC)nc(N(C)C)n1.
What is the InChIKey of 4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine?
The InChIKey is LQJYTNBYICJMDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-11(2)8-9-6(12-3)5-7(10-8)13-4/h5H,1-4H3.
What are the key properties of 4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine?
4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine has a molecular weight of 183.21 g/mol, XLogP of 0.56, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxy-N,N-dimethylpyrimidin-2-amine is sourced from PubChem (CID 838369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).