4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine

C15H28N6 — CID 80827383

IUPAC4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine
SMILESCCNc1nc(NC2CCC(C)C(C)C2)nc(N(C)C)n1
InChIInChI=1S/C15H28N6/c1-6-16-13-18-14(20-15(19-13)21(4)5)17-12-8-7-10(2)11(3)9-12/h10-12H,6-9H2,1-5H3,(H2,16,17,18,19,20)
InChIKeyMDNOQRATJSBPHK-UHFFFAOYSA-N
MW292.43 g/mol
LogP2.61
Rot. Bonds5

About 4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine

4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 80827383) has the molecular formula C15H28N6 and a molecular weight of 292.43 g/mol. Its IUPAC name is 4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine
PubChem CID80827383
Molecular FormulaC15H28N6
Molecular Weight292.43 g/mol
Exact Mass292.24
IUPAC Name4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine
SMILESCCNc1nc(NC2CCC(C)C(C)C2)nc(N(C)C)n1
InChIInChI=1S/C15H28N6/c1-6-16-13-18-14(20-15(19-13)21(4)5)17-12-8-7-10(2)11(3)9-12/h10-12H,6-9H2,1-5H3,(H2,16,17,18,19,20)
InChIKeyMDNOQRATJSBPHK-UHFFFAOYSA-N
XLogP2.61
TPSA65.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.43
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine with MolForge

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Launch Full Analysis

Related Compounds

6-N-ethyl-2-N,2-N-dimethyl-4-N-(4-methylcyclohexyl)-1,3,5-triazine-2,4,6-triamine
CID 80771442
2-N-(3,4-dimethylcyclohexyl)-6-hydrazinyl-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80915102
4-N-(1,1-dioxothiolan-3-yl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 80786050
2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine
CID 114541935
2-N-(cyclopropylmethyl)-6-N-ethyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4,6-triamine
CID 80797993
4-N-cyclohexyl-2-N,2-N-dimethyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80766155
6-hydrazinyl-4-N,4-N-dimethyl-2-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4-diamine
CID 114542312
6-(2,2-dimethylhydrazinyl)-2-N-ethyl-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 83027111
N-(3,4-dimethylcyclohexyl)-4,6-dimethylpyrimidin-2-amine
CID 64741526
2-N-cyclopropyl-4-N-ethyl-6-methylsulfanyl-1,3,5-triazine-2,4-diamine
CID 12979265
2-N,2-N-dimethyl-6-N-propyl-4-N-(thiolan-3-yl)-1,3,5-triazine-2,4,6-triamine
CID 103065188
2-N-butyl-2-N-cyclopropyl-6-N-ethyl-4-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 80799249

Frequently Asked Questions

What is the IUPAC name of 4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine (CID 80827383) is 4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine is CCNc1nc(NC2CCC(C)C(C)C2)nc(N(C)C)n1.
What is the InChIKey of 4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is MDNOQRATJSBPHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N6/c1-6-16-13-18-14(20-15(19-13)21(4)5)17-12-8-7-10(2)11(3)9-12/h10-12H,6-9H2,1-5H3,(H2,16,17,18,19,20).
What are the key properties of 4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine?
4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 292.43 g/mol, XLogP of 2.61, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 80827383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).