6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine

C15H26N4 — CID 80819002

IUPAC6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine
SMILESCCNc1ncnc(NC2(C)CCCCC2)c1CC
InChIInChI=1S/C15H26N4/c1-4-12-13(16-5-2)17-11-18-14(12)19-15(3)9-7-6-8-10-15/h11H,4-10H2,1-3H3,(H2,16,17,18,19)
InChIKeyPPEGBADKHBPQDM-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.61
Rot. Bonds5

About 6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine

6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine (PubChem CID 80819002) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine
PubChem CID80819002
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine
SMILESCCNc1ncnc(NC2(C)CCCCC2)c1CC
InChIInChI=1S/C15H26N4/c1-4-12-13(16-5-2)17-11-18-14(12)19-15(3)9-7-6-8-10-15/h11H,4-10H2,1-3H3,(H2,16,17,18,19)
InChIKeyPPEGBADKHBPQDM-UHFFFAOYSA-N
XLogP3.61
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-6-hydrazinyl-N-(1-methylcyclopentyl)pyrimidin-4-amine
CID 80915172
4-N-cyclopentyl-6-N,5-diethylpyrimidine-4,6-diamine
CID 80770074
6-N,5-diethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-4,6-diamine
CID 80848453
[1-[[6-(ethylamino)-5-propylpyrimidin-4-yl]amino]cyclohexyl]methanol
CID 80804152
[1-[[5-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]-3-methylcyclohexyl]methanol
CID 80803825
5-ethyl-4-N-(3-methyloxan-3-yl)pyrimidine-4,6-diamine
CID 114114617
5-ethyl-4-N-[(1-methylcyclopentyl)methyl]-6-N-propylpyrimidine-4,6-diamine
CID 80845667
6-N,5-diethyl-4-N-(2-methylcyclohexyl)pyrimidine-4,6-diamine
CID 80777757
2-[[5-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 80826428
1-[[[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-methylamino]methyl]cyclopentan-1-ol
CID 114954073
4-N-(1,1-dioxothian-4-yl)-6-N,5-diethylpyrimidine-4,6-diamine
CID 80789952
6-N,5-diethyl-4-N-pentan-3-ylpyrimidine-4,6-diamine
CID 80769783

Frequently Asked Questions

What is the IUPAC name of 6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine?
The IUPAC name of 6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine (CID 80819002) is 6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine?
The canonical SMILES for 6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine is CCNc1ncnc(NC2(C)CCCCC2)c1CC.
What is the InChIKey of 6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine?
The InChIKey is PPEGBADKHBPQDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-4-12-13(16-5-2)17-11-18-14(12)19-15(3)9-7-6-8-10-15/h11H,4-10H2,1-3H3,(H2,16,17,18,19).
What are the key properties of 6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine?
6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine has a molecular weight of 262.40 g/mol, XLogP of 3.61, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,5-diethyl-4-N-(1-methylcyclohexyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 80819002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).