6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine

C13H22N4 — CID 55188732

IUPAC6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine
SMILESCCNc1cc(C2CC2)nc(N(CC)CC)n1
InChIInChI=1S/C13H22N4/c1-4-14-12-9-11(10-7-8-10)15-13(16-12)17(5-2)6-3/h9-10H,4-8H2,1-3H3,(H,14,15,16)
InChIKeyOXFMLDJJIAUHMH-UHFFFAOYSA-N
MW234.35 g/mol
LogP2.63
Rot. Bonds6

About 6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine

6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine (PubChem CID 55188732) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine
PubChem CID55188732
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine
SMILESCCNc1cc(C2CC2)nc(N(CC)CC)n1
InChIInChI=1S/C13H22N4/c1-4-14-12-9-11(10-7-8-10)15-13(16-12)17(5-2)6-3/h9-10H,4-8H2,1-3H3,(H,14,15,16)
InChIKeyOXFMLDJJIAUHMH-UHFFFAOYSA-N
XLogP2.63
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-cyclopropyl-N-ethyl-2-(4-ethylcyclohexyl)pyrimidin-4-amine
CID 65389352
2-N,2-N,4-N-triethyl-6-phenylpyrimidine-2,4-diamine
CID 63485028
6-cyclopropyl-N-ethyl-2-(4-propylcyclohexyl)pyrimidin-4-amine
CID 65402191
6-cyclopropyl-2-(2,4-dimethylphenyl)-N-ethylpyrimidin-4-amine
CID 63354598
6-cyclopropyl-2-(2,4-dichlorophenyl)-N-ethylpyrimidin-4-amine
CID 63481714
6-cyclopropyl-N-ethyl-2-(4-methylpiperazin-1-yl)pyrimidin-4-amine
CID 55188731
6-cyclopropyl-N-ethyl-2-(2-methoxyphenyl)pyrimidin-4-amine
CID 63354262
2-cyclopropyl-4-N,6-N-diethyl-4-N-(2-methylpropyl)pyrimidine-4,6-diamine
CID 80967980
6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine
CID 63354175
6-cyclopropyl-N-ethyl-2-pyrazin-2-ylpyrimidin-4-amine
CID 63354437
6-cyclopropyl-N-ethyl-2-thiophen-2-ylpyrimidin-4-amine
CID 63354572
2-cyclopropyl-4-N,6-N-diethyl-4-N-(2-ethylbutyl)pyrimidine-4,6-diamine
CID 80961233

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine?
The IUPAC name of 6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine (CID 55188732) is 6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine.
What is the SMILES notation for 6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine?
The canonical SMILES for 6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine is CCNc1cc(C2CC2)nc(N(CC)CC)n1.
What is the InChIKey of 6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine?
The InChIKey is OXFMLDJJIAUHMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-4-14-12-9-11(10-7-8-10)15-13(16-12)17(5-2)6-3/h9-10H,4-8H2,1-3H3,(H,14,15,16).
What are the key properties of 6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine?
6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine has a molecular weight of 234.35 g/mol, XLogP of 2.63, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine is sourced from PubChem (CID 55188732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).