6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine

C15H26N4 — CID 103968628

IUPAC6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine
SMILESCNc1cc(NC2CC(C)(C)CC(C)(C)C2)ncn1
InChIInChI=1S/C15H26N4/c1-14(2)7-11(8-15(3,4)9-14)19-13-6-12(16-5)17-10-18-13/h6,10-11H,7-9H2,1-5H3,(H2,16,17,18,19)
InChIKeyKLEKNPBYRYZFAY-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.54
Rot. Bonds3

About 6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine

6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine (PubChem CID 103968628) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine
PubChem CID103968628
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine
SMILESCNc1cc(NC2CC(C)(C)CC(C)(C)C2)ncn1
InChIInChI=1S/C15H26N4/c1-14(2)7-11(8-15(3,4)9-14)19-13-6-12(16-5)17-10-18-13/h6,10-11H,7-9H2,1-5H3,(H2,16,17,18,19)
InChIKeyKLEKNPBYRYZFAY-UHFFFAOYSA-N
XLogP3.54
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine
CID 131047920
N-(3,3,5,5-tetramethylcyclohexyl)quinolin-2-amine
CID 103967142
4-N-(3,5-dimethyl-1-adamantyl)-6-N-methylpyrimidine-4,6-diamine
CID 80839445
5-fluoro-N-(3,3,5,5-tetramethylcyclohexyl)pyridin-2-amine
CID 103967192
4-N-(3-methoxy-2,2-dimethylcyclobutyl)-6-N-methylpyrimidine-4,6-diamine
CID 114121036
6-methyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine
CID 16876383
N-(3,3-dimethylcyclopentyl)-6-ethylpyrimidin-4-amine
CID 115880999
6-chloro-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,5-diamine
CID 103965332
6-N-methyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine
CID 80829208
6-methoxy-2-methyl-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidin-4-amine
CID 103967188
6-ethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)pyrimidin-4-amine
CID 144655156
6-methoxy-5-methyl-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidin-4-amine
CID 103967116

Frequently Asked Questions

What is the IUPAC name of 6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine?
The IUPAC name of 6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine (CID 103968628) is 6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine.
What is the SMILES notation for 6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine?
The canonical SMILES for 6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine is CNc1cc(NC2CC(C)(C)CC(C)(C)C2)ncn1.
What is the InChIKey of 6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine?
The InChIKey is KLEKNPBYRYZFAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-14(2)7-11(8-15(3,4)9-14)19-13-6-12(16-5)17-10-18-13/h6,10-11H,7-9H2,1-5H3,(H2,16,17,18,19).
What are the key properties of 6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine?
6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine has a molecular weight of 262.40 g/mol, XLogP of 3.54, 3 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-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine is sourced from PubChem (CID 103968628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).