(2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine

C8H17N5 — CID 136590867

IUPAC(2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine
SMILESC/N=C1\N[C@H](C)N=C(N(C)C)N1C
InChIInChI=1S/C8H17N5/c1-6-10-7(9-2)13(5)8(11-6)12(3)4/h6H,1-5H3,(H,9,10)/t6-/m0/s1
InChIKeySQNGLDMOUXNCPB-LURJTMIESA-N
MW183.26 g/mol
LogP-0.23
Rot. Bonds

About (2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine

(2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine (PubChem CID 136590867) has the molecular formula C8H17N5 and a molecular weight of 183.26 g/mol. Its IUPAC name is (2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine.

Molecular Properties

Compound Name(2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine
PubChem CID136590867
Molecular FormulaC8H17N5
Molecular Weight183.26 g/mol
Exact Mass183.15
IUPAC Name(2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine
SMILESC/N=C1\N[C@H](C)N=C(N(C)C)N1C
InChIInChI=1S/C8H17N5/c1-6-10-7(9-2)13(5)8(11-6)12(3)4/h6H,1-5H3,(H,9,10)/t6-/m0/s1
InChIKeySQNGLDMOUXNCPB-LURJTMIESA-N
XLogP-0.23
TPSA43.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.26
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine?
The IUPAC name of (2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine (CID 136590867) is (2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine.
What is the SMILES notation for (2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine?
The canonical SMILES for (2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine is C/N=C1\N[C@H](C)N=C(N(C)C)N1C.
What is the InChIKey of (2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine?
The InChIKey is SQNGLDMOUXNCPB-LURJTMIESA-N. The full InChI is InChI=1S/C8H17N5/c1-6-10-7(9-2)13(5)8(11-6)12(3)4/h6H,1-5H3,(H,9,10)/t6-/m0/s1.
What are the key properties of (2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine?
(2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine has a molecular weight of 183.26 g/mol, XLogP of -0.23, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N,N,2,5-tetramethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine is sourced from PubChem (CID 136590867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).