4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine

C14H23F3N4 — CID 106770292

IUPAC4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine
SMILESCCCNc1cc(N(CCC)CCC)nc(C(F)(F)F)n1
InChIInChI=1S/C14H23F3N4/c1-4-7-18-11-10-12(21(8-5-2)9-6-3)20-13(19-11)14(15,16)17/h10H,4-9H2,1-3H3,(H,18,19,20)
InChIKeyCPGWTNGDLLQCFH-UHFFFAOYSA-N
MW304.36 g/mol
LogP3.94
Rot. Bonds8

About 4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine

4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine (PubChem CID 106770292) has the molecular formula C14H23F3N4 and a molecular weight of 304.36 g/mol. Its IUPAC name is 4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine
PubChem CID106770292
Molecular FormulaC14H23F3N4
Molecular Weight304.36 g/mol
Exact Mass304.19
IUPAC Name4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine
SMILESCCCNc1cc(N(CCC)CCC)nc(C(F)(F)F)n1
InChIInChI=1S/C14H23F3N4/c1-4-7-18-11-10-12(21(8-5-2)9-6-3)20-13(19-11)14(15,16)17/h10H,4-9H2,1-3H3,(H,18,19,20)
InChIKeyCPGWTNGDLLQCFH-UHFFFAOYSA-N
XLogP3.94
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.36
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-N-ethyl-4-N,4-N-dipropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106770291
6-N-methyl-4-N,4-N-dipropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106770293
4-N-methyl-4-N-(2-methylbutan-2-yl)-6-N-propyl-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106772089
2-[propyl-[6-(propylamino)-4-(trifluoromethyl)-2-pyridinyl]amino]ethanol
CID 102717771
4-N,4-N,6-N,2-tetrapropylpyrimidine-4,6-diamine
CID 80946312
6-[3-(dimethylamino)propoxy]-N-propyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106774344
4-N-(2-methylsulfanylethyl)-6-N-propyl-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106772093
2-tert-butyl-4-N-cyclopropyl-4-N,6-N-dipropylpyrimidine-4,6-diamine
CID 80960352
4-[[6-(propylamino)-2-(trifluoromethyl)pyrimidin-4-yl]amino]butan-1-ol
CID 106846982
6-phenyl-N-propyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106769168
4-N-pentan-2-yl-6-N-propyl-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106770408
6-N-ethyl-4-N-methyl-4-N-pentyl-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106770662

Frequently Asked Questions

What is the IUPAC name of 4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine?
The IUPAC name of 4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine (CID 106770292) is 4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine?
The canonical SMILES for 4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine is CCCNc1cc(N(CCC)CCC)nc(C(F)(F)F)n1.
What is the InChIKey of 4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine?
The InChIKey is CPGWTNGDLLQCFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F3N4/c1-4-7-18-11-10-12(21(8-5-2)9-6-3)20-13(19-11)14(15,16)17/h10H,4-9H2,1-3H3,(H,18,19,20).
What are the key properties of 4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine?
4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine has a molecular weight of 304.36 g/mol, XLogP of 3.94, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N,6-N-tripropyl-2-(trifluoromethyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 106770292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).