6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine

C13H17N5O — CID 103375001

IUPAC6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine
SMILESCCc1nc(-c2ccc(OC)nn2)nc(NC)c1C
InChIInChI=1S/C13H17N5O/c1-5-9-8(2)12(14-3)16-13(15-9)10-6-7-11(19-4)18-17-10/h6-7H,5H2,1-4H3,(H,14,15,16)
InChIKeyIQTVOSRVRRUIND-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.85
Rot. Bonds4

About 6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine

6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine (PubChem CID 103375001) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is 6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine
PubChem CID103375001
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine
SMILESCCc1nc(-c2ccc(OC)nn2)nc(NC)c1C
InChIInChI=1S/C13H17N5O/c1-5-9-8(2)12(14-3)16-13(15-9)10-6-7-11(19-4)18-17-10/h6-7H,5H2,1-4H3,(H,14,15,16)
InChIKeyIQTVOSRVRRUIND-UHFFFAOYSA-N
XLogP1.85
TPSA72.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-ethyl-2-(6-methoxypyridazin-3-yl)-5-methylpyrimidin-4-amine
CID 103375000
6-ethyl-5-iodo-2-(6-methoxypyridazin-3-yl)-N-propylpyrimidin-4-amine
CID 103375031
6-ethyl-2-(4-ethylphenyl)-N,5-dimethylpyrimidin-4-amine
CID 63562088
2-(3-chloro-4-methoxyphenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 65022448
6-ethyl-N,5-dimethyl-2-pyrimidin-2-ylpyrimidin-4-amine
CID 63561722
2-(2,6-dichlorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 55222206
5-(chloromethyl)-4-ethyl-2-(6-methoxypyridazin-3-yl)pyrimidine
CID 114205394
2-(2,4-dimethylphenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 63561539
2-(2-chlorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 63560185
6-ethyl-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
CID 63560963
2-(3,5-difluorophenyl)-6-ethyl-N,5-dimethylpyrimidin-4-amine
CID 63562473
6-ethyl-5-iodo-2-(6-methoxy-3-pyridinyl)-N-methylpyrimidin-4-amine
CID 114938393

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine?
The IUPAC name of 6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine (CID 103375001) is 6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine is CCc1nc(-c2ccc(OC)nn2)nc(NC)c1C.
What is the InChIKey of 6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine?
The InChIKey is IQTVOSRVRRUIND-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-5-9-8(2)12(14-3)16-13(15-9)10-6-7-11(19-4)18-17-10/h6-7H,5H2,1-4H3,(H,14,15,16).
What are the key properties of 6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine?
6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine has a molecular weight of 259.31 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-(6-methoxypyridazin-3-yl)-N,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 103375001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).