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

C10H18N6 — CID 80826128

IUPAC2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine
SMILESCNc1nc(NC2CC2C)nc(N(C)C)n1
InChIInChI=1S/C10H18N6/c1-6-5-7(6)12-9-13-8(11-2)14-10(15-9)16(3)4/h6-7H,5H2,1-4H3,(H2,11,12,13,14,15)
InChIKeyNIXTZCZSRYZQFT-UHFFFAOYSA-N
MW222.30 g/mol
LogP0.80
Rot. Bonds4

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

2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 80826128) has the molecular formula C10H18N6 and a molecular weight of 222.30 g/mol. Its IUPAC name is 2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine
PubChem CID80826128
Molecular FormulaC10H18N6
Molecular Weight222.30 g/mol
Exact Mass222.16
IUPAC Name2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine
SMILESCNc1nc(NC2CC2C)nc(N(C)C)n1
InChIInChI=1S/C10H18N6/c1-6-5-7(6)12-9-13-8(11-2)14-10(15-9)16(3)4/h6-7H,5H2,1-4H3,(H2,11,12,13,14,15)
InChIKeyNIXTZCZSRYZQFT-UHFFFAOYSA-N
XLogP0.80
TPSA65.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.30
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine (CID 80826128) is 2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine is CNc1nc(NC2CC2C)nc(N(C)C)n1.
What is the InChIKey of 2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is NIXTZCZSRYZQFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N6/c1-6-5-7(6)12-9-13-8(11-2)14-10(15-9)16(3)4/h6-7H,5H2,1-4H3,(H2,11,12,13,14,15).
What are the key properties of 2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine?
2-N,2-N,6-N-trimethyl-4-N-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 222.30 g/mol, XLogP of 0.80, 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-(2-methylcyclopropyl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 80826128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).