2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine

C10H20N6 — CID 18715895

IUPAC2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine
SMILESCc1nc(N(C)C)nc(N(C)CN(C)C)n1
InChIInChI=1S/C10H20N6/c1-8-11-9(15(4)5)13-10(12-8)16(6)7-14(2)3/h7H2,1-6H3
InChIKeyJNQNTKQHOJBKFV-UHFFFAOYSA-N
MW224.31 g/mol
LogP0.20
Rot. Bonds4

About 2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine

2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine (PubChem CID 18715895) has the molecular formula C10H20N6 and a molecular weight of 224.31 g/mol. Its IUPAC name is 2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine
PubChem CID18715895
Molecular FormulaC10H20N6
Molecular Weight224.31 g/mol
Exact Mass224.17
IUPAC Name2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine
SMILESCc1nc(N(C)C)nc(N(C)CN(C)C)n1
InChIInChI=1S/C10H20N6/c1-8-11-9(15(4)5)13-10(12-8)16(6)7-14(2)3/h7H2,1-6H3
InChIKeyJNQNTKQHOJBKFV-UHFFFAOYSA-N
XLogP0.20
TPSA48.39 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 50.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine (CID 18715895) is 2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine is Cc1nc(N(C)C)nc(N(C)CN(C)C)n1.
What is the InChIKey of 2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is JNQNTKQHOJBKFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N6/c1-8-11-9(15(4)5)13-10(12-8)16(6)7-14(2)3/h7H2,1-6H3.
What are the key properties of 2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine?
2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 224.31 g/mol, XLogP of 0.20, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[(dimethylamino)methyl]-2-N,4-N,4-N,6-tetramethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 18715895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).