2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine

C14H25N7 — CID 80835288

IUPAC2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(N(C)C)nc(N2CCC3CCC(C2)N3C)n1
InChIInChI=1S/C14H25N7/c1-15-12-16-13(19(2)3)18-14(17-12)21-8-7-10-5-6-11(9-21)20(10)4/h10-11H,5-9H2,1-4H3,(H,15,16,17,18)
InChIKeyHQOFDSGLCDMZDZ-UHFFFAOYSA-N
MW291.40 g/mol
LogP0.65
Rot. Bonds3

About 2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine

2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 80835288) has the molecular formula C14H25N7 and a molecular weight of 291.40 g/mol. Its IUPAC name is 2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine
PubChem CID80835288
Molecular FormulaC14H25N7
Molecular Weight291.40 g/mol
Exact Mass291.22
IUPAC Name2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(N(C)C)nc(N2CCC3CCC(C2)N3C)n1
InChIInChI=1S/C14H25N7/c1-15-12-16-13(19(2)3)18-14(17-12)21-8-7-10-5-6-11(9-21)20(10)4/h10-11H,5-9H2,1-4H3,(H,15,16,17,18)
InChIKeyHQOFDSGLCDMZDZ-UHFFFAOYSA-N
XLogP0.65
TPSA60.42 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-3-methylpiperidin-4-ol
CID 114684030
4-hydrazinyl-N,N-dimethyl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)-1,3,5-triazin-2-amine
CID 80905094
7-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one
CID 80836471
2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80764986
6-(2,6-dimethylmorpholin-4-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80764948
4-chloro-N,N-dimethyl-6-(3-piperidin-1-ylpyrrolidin-1-yl)-1,3,5-triazin-2-amine
CID 63171122
1-[4-(dimethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]-4-methylazepan-4-ol
CID 107409153
6-(2,4-dimethylpiperidin-1-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80826737
4-chloro-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-propyl-1,3,5-triazin-2-amine
CID 80835290
4-chloro-N,N-dimethyl-6-(3-morpholin-4-ylpyrrolidin-1-yl)-1,3,5-triazin-2-amine
CID 63171342
6-(2-cyclopentylpyrrolidin-1-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80792754
6-(3,4-dihydro-1H-isoquinolin-2-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80751354

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine (CID 80835288) is 2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine is CNc1nc(N(C)C)nc(N2CCC3CCC(C2)N3C)n1.
What is the InChIKey of 2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine?
The InChIKey is HQOFDSGLCDMZDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N7/c1-15-12-16-13(19(2)3)18-14(17-12)21-8-7-10-5-6-11(9-21)20(10)4/h10-11H,5-9H2,1-4H3,(H,15,16,17,18).
What are the key properties of 2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine?
2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 291.40 g/mol, XLogP of 0.65, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N,4-N-trimethyl-6-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80835288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).