6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine

C18H25N3 — CID 80977653

IUPAC6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(CC)nc(-c2cc(C)ccc2C)c1C
InChIInChI=1S/C18H25N3/c1-6-10-19-18-14(5)17(20-16(7-2)21-18)15-11-12(3)8-9-13(15)4/h8-9,11H,6-7,10H2,1-5H3,(H,19,20,21)
InChIKeySCSJHXLAONLVOZ-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.45
Rot. Bonds5

About 6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine

6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine (PubChem CID 80977653) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine
PubChem CID80977653
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(CC)nc(-c2cc(C)ccc2C)c1C
InChIInChI=1S/C18H25N3/c1-6-10-19-18-14(5)17(20-16(7-2)21-18)15-11-12(3)8-9-13(15)4/h8-9,11H,6-7,10H2,1-5H3,(H,19,20,21)
InChIKeySCSJHXLAONLVOZ-UHFFFAOYSA-N
XLogP4.45
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-5-methyl-6-(3-methylphenyl)-N-propylpyrimidin-4-amine
CID 80975147
2-ethyl-6-(2-fluorophenyl)-5-methyl-N-propylpyrimidin-4-amine
CID 80975172
2-ethyl-6-(3-fluoro-4-methylphenyl)-5-methyl-N-propylpyrimidin-4-amine
CID 115502692
2-ethyl-6-(4-fluoro-3-methylphenyl)-5-methyl-N-propylpyrimidin-4-amine
CID 80978174
6-(2,3-dichlorophenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine
CID 80970830
2-ethyl-5-methyl-4-N-(4-methylphenyl)-6-N-propylpyrimidine-4,6-diamine
CID 80980584
6-(2,3-difluoro-4-methylphenyl)-N,2-diethyl-5-methylpyrimidin-4-amine
CID 107514529
6-N,2-diethyl-5-methyl-4-N-propylpyrimidine-4,6-diamine
CID 80980725
2-ethyl-6-N,5-dimethyl-4-N-propylpyrimidine-4,6-diamine
CID 80982045
2-(2,5-dimethylphenyl)-5-iodo-6-methyl-N-propylpyrimidin-4-amine
CID 66297674
2-tert-butyl-6-(2,5-dimethylphenyl)-N,5-dimethylpyrimidin-4-amine
CID 80977836
N,2-diethyl-6-(3-fluoro-4-methylphenyl)-5-methylpyrimidin-4-amine
CID 115502727

Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine?
The IUPAC name of 6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine (CID 80977653) is 6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine?
The canonical SMILES for 6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine is CCCNc1nc(CC)nc(-c2cc(C)ccc2C)c1C.
What is the InChIKey of 6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine?
The InChIKey is SCSJHXLAONLVOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-6-10-19-18-14(5)17(20-16(7-2)21-18)15-11-12(3)8-9-13(15)4/h8-9,11H,6-7,10H2,1-5H3,(H,19,20,21).
What are the key properties of 6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine?
6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine has a molecular weight of 283.42 g/mol, XLogP of 4.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dimethylphenyl)-2-ethyl-5-methyl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 80977653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).