2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine

C7H14N6 — CID 21483311

IUPAC2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine
SMILESCNc1nc(N)c(N(C)C)c(N)n1
InChIInChI=1S/C7H14N6/c1-10-7-11-5(8)4(13(2)3)6(9)12-7/h1-3H3,(H5,8,9,10,11,12)
InChIKeyHTWFWYCFQCMMDO-UHFFFAOYSA-N
MW182.23 g/mol
LogP-0.25
Rot. Bonds2

About 2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine

2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine (PubChem CID 21483311) has the molecular formula C7H14N6 and a molecular weight of 182.23 g/mol. Its IUPAC name is 2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine.

Molecular Properties

Compound Name2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine
PubChem CID21483311
Molecular FormulaC7H14N6
Molecular Weight182.23 g/mol
Exact Mass182.13
IUPAC Name2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine
SMILESCNc1nc(N)c(N(C)C)c(N)n1
InChIInChI=1S/C7H14N6/c1-10-7-11-5(8)4(13(2)3)6(9)12-7/h1-3H3,(H5,8,9,10,11,12)
InChIKeyHTWFWYCFQCMMDO-UHFFFAOYSA-N
XLogP-0.25
TPSA93.09 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 5-0.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine?
The IUPAC name of 2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine (CID 21483311) is 2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine.
What is the SMILES notation for 2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine?
The canonical SMILES for 2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine is CNc1nc(N)c(N(C)C)c(N)n1.
What is the InChIKey of 2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine?
The InChIKey is HTWFWYCFQCMMDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N6/c1-10-7-11-5(8)4(13(2)3)6(9)12-7/h1-3H3,(H5,8,9,10,11,12).
What are the key properties of 2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine?
2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine has a molecular weight of 182.23 g/mol, XLogP of -0.25, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,5-N,5-N-trimethylpyrimidine-2,4,5,6-tetramine is sourced from PubChem (CID 21483311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).