4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine

C14H24N4 — CID 80835086

IUPAC4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine
SMILESCc1nc(N)c(C)c(NC2CCC(C)CC2C)n1
InChIInChI=1S/C14H24N4/c1-8-5-6-12(9(2)7-8)18-14-10(3)13(15)16-11(4)17-14/h8-9,12H,5-7H2,1-4H3,(H3,15,16,17,18)
InChIKeyFUCBAVXICPVMFC-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.91
Rot. Bonds2

About 4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine

4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine (PubChem CID 80835086) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine
PubChem CID80835086
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine
SMILESCc1nc(N)c(C)c(NC2CCC(C)CC2C)n1
InChIInChI=1S/C14H24N4/c1-8-5-6-12(9(2)7-8)18-14-10(3)13(15)16-11(4)17-14/h8-9,12H,5-7H2,1-4H3,(H3,15,16,17,18)
InChIKeyFUCBAVXICPVMFC-UHFFFAOYSA-N
XLogP2.91
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dimethyl-4-N-(2-methylcyclopropyl)pyrimidine-4,6-diamine
CID 80826930
2,5-dimethyl-4-N-(2-methylcyclopentyl)pyrimidine-4,6-diamine
CID 80829505
2,5-dimethyl-4-N-(4-methylcyclohexyl)pyrimidine-4,6-diamine
CID 80771822
N-(2,4-dimethylcyclohexyl)-6-hydrazinyl-5-methyl-2-propylpyrimidin-4-amine
CID 81005985
N-(2,4-dimethylcyclohexyl)-6-hydrazinyl-2-methylpyrimidin-4-amine
CID 80911652
4-N-(2,4-dimethylcyclohexyl)pyrimidine-4,5-diamine
CID 79915809
4-N-(2,3-dimethylcyclopentyl)-5-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80992914
3-N-(2,4-dimethylcyclohexyl)-2-methylbenzene-1,3-diamine
CID 63995449
4-N-(1,1-dioxothiolan-3-yl)-2,5-dimethylpyrimidine-4,6-diamine
CID 80786199
6-chloro-N-(2,3-dimethylcyclopentyl)-2,5-dimethylpyrimidin-4-amine
CID 64920876
4-N-(2,6-dimethylpiperidin-1-yl)-2,5-dimethylpyrimidine-4,6-diamine
CID 83028090
5-N-(2,4-dimethylcyclohexyl)-2-methyl-1,3-benzothiazole-5,6-diamine
CID 63995855

Frequently Asked Questions

What is the IUPAC name of 4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine (CID 80835086) is 4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine is Cc1nc(N)c(C)c(NC2CCC(C)CC2C)n1.
What is the InChIKey of 4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine?
The InChIKey is FUCBAVXICPVMFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-8-5-6-12(9(2)7-8)18-14-10(3)13(15)16-11(4)17-14/h8-9,12H,5-7H2,1-4H3,(H3,15,16,17,18).
What are the key properties of 4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine?
4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine has a molecular weight of 248.37 g/mol, XLogP of 2.91, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2,4-dimethylcyclohexyl)-2,5-dimethylpyrimidine-4,6-diamine is sourced from PubChem (CID 80835086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).