6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine

C15H26N4 — CID 80772693

IUPAC6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine
SMILESCNc1ncnc(NC2CCC(C)CC2)c1C(C)C
InChIInChI=1S/C15H26N4/c1-10(2)13-14(16-4)17-9-18-15(13)19-12-7-5-11(3)6-8-12/h9-12H,5-8H2,1-4H3,(H2,16,17,18,19)
InChIKeyGLJSMOUOJOGBRI-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.63
Rot. Bonds4

About 6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine

6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine (PubChem CID 80772693) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine
PubChem CID80772693
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine
SMILESCNc1ncnc(NC2CCC(C)CC2)c1C(C)C
InChIInChI=1S/C15H26N4/c1-10(2)13-14(16-4)17-9-18-15(13)19-12-7-5-11(3)6-8-12/h9-12H,5-8H2,1-4H3,(H2,16,17,18,19)
InChIKeyGLJSMOUOJOGBRI-UHFFFAOYSA-N
XLogP3.63
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-(4-methylcycloheptyl)-5-propan-2-ylpyrimidin-4-amine
CID 114101538
6-N-methyl-5-propan-2-yl-4-N-(1-propylpiperidin-4-yl)pyrimidine-4,6-diamine
CID 80783092
6-N,5-dimethyl-4-N-(4-methylcyclohexyl)pyrimidine-4,6-diamine
CID 80771823
6-(3,5-dimethylcyclohexyl)oxy-N-methyl-5-propan-2-ylpyrimidin-4-amine
CID 80878317
4-N-(3-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine
CID 80782403
2,2-dimethyl-3-[[6-(methylamino)-5-propan-2-ylpyrimidin-4-yl]amino]cyclobutan-1-ol
CID 114632856
4-N-(3,5-dimethylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine
CID 80840974
4-N-(4,4-dimethylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine
CID 80838058
[3-methyl-1-[[6-(methylamino)-5-propan-2-ylpyrimidin-4-yl]amino]cyclohexyl]methanol
CID 80803951
6-chloro-5-ethyl-N-(4-methylcyclohexyl)pyrimidin-4-amine
CID 63729756
5-ethyl-6-hydrazinyl-N-(4-methylcyclohexyl)pyrimidin-4-amine
CID 80944076
2-(hydroxymethyl)-2-[[6-(methylamino)-5-propan-2-ylpyrimidin-4-yl]amino]propane-1,3-diol
CID 107855651

Frequently Asked Questions

What is the IUPAC name of 6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine?
The IUPAC name of 6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine (CID 80772693) is 6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine.
What is the SMILES notation for 6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine?
The canonical SMILES for 6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine is CNc1ncnc(NC2CCC(C)CC2)c1C(C)C.
What is the InChIKey of 6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine?
The InChIKey is GLJSMOUOJOGBRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-10(2)13-14(16-4)17-9-18-15(13)19-12-7-5-11(3)6-8-12/h9-12H,5-8H2,1-4H3,(H2,16,17,18,19).
What are the key properties of 6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine?
6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine has a molecular weight of 262.40 g/mol, XLogP of 3.63, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-methyl-4-N-(4-methylcyclohexyl)-5-propan-2-ylpyrimidine-4,6-diamine is sourced from PubChem (CID 80772693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).