2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine

C12H22N6 — CID 114541935

IUPAC2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine
SMILESCNc1nc(NC2CCC(C)C2)nc(N(C)C)n1
InChIInChI=1S/C12H22N6/c1-8-5-6-9(7-8)14-11-15-10(13-2)16-12(17-11)18(3)4/h8-9H,5-7H2,1-4H3,(H2,13,14,15,16,17)
InChIKeyPCCQXTBTADFQRV-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.58
Rot. Bonds4

About 2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine

2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 114541935) has the molecular formula C12H22N6 and a molecular weight of 250.35 g/mol. Its IUPAC name is 2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine
PubChem CID114541935
Molecular FormulaC12H22N6
Molecular Weight250.35 g/mol
Exact Mass250.19
IUPAC Name2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine
SMILESCNc1nc(NC2CCC(C)C2)nc(N(C)C)n1
InChIInChI=1S/C12H22N6/c1-8-5-6-9(7-8)14-11-15-10(13-2)16-12(17-11)18(3)4/h8-9H,5-7H2,1-4H3,(H2,13,14,15,16,17)
InChIKeyPCCQXTBTADFQRV-UHFFFAOYSA-N
XLogP1.58
TPSA65.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-hydrazinyl-4-N,4-N-dimethyl-2-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4-diamine
CID 114542312
6-chloro-4-N-methyl-2-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4-diamine
CID 114541947
2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine
CID 80826128
2-N,2-N,6-N-trimethyl-4-N-(1-propylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 80783238
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-(3,4-dimethylcyclohexyl)-6-N-ethyl-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 80827383
2-N,2-N,6-N-trimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)-1,3,5-triazine-2,4,6-triamine
CID 80849007
6-(2,4-dimethylpiperidin-1-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80826737
2-N-methyl-4-N-(3-methylcyclopentyl)-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114566037
4-N-methyl-2-N-(4-methylcyclohexyl)-6-pyrazol-1-yl-1,3,5-triazine-2,4-diamine
CID 80773650
4-N-cyclohexyl-2-N,2-N-dimethyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80766155

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine (CID 114541935) is 2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine is CNc1nc(NC2CCC(C)C2)nc(N(C)C)n1.
What is the InChIKey of 2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is PCCQXTBTADFQRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N6/c1-8-5-6-9(7-8)14-11-15-10(13-2)16-12(17-11)18(3)4/h8-9H,5-7H2,1-4H3,(H2,13,14,15,16,17).
What are the key properties of 2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine?
2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 250.35 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,6-N-trimethyl-4-N-(3-methylcyclopentyl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 114541935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).