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

C6H13N5 — CID 136590852

IUPAC(2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine
SMILESC/N=C1\N[C@H](C)N=C(N)N1C
InChIInChI=1S/C6H13N5/c1-4-9-5(7)11(3)6(8-2)10-4/h4H,1-3H3,(H2,7,9)(H,8,10)/t4-/m1/s1
InChIKeyQSLSTULTYMRONL-SCSAIBSYSA-N
MW155.20 g/mol
LogP-0.83
Rot. Bonds

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

(2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine (PubChem CID 136590852) has the molecular formula C6H13N5 and a molecular weight of 155.20 g/mol. Its IUPAC name is (2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine.

Molecular Properties

Compound Name(2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine
PubChem CID136590852
Molecular FormulaC6H13N5
Molecular Weight155.20 g/mol
Exact Mass155.12
IUPAC Name(2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine
SMILESC/N=C1\N[C@H](C)N=C(N)N1C
InChIInChI=1S/C6H13N5/c1-4-9-5(7)11(3)6(8-2)10-4/h4H,1-3H3,(H2,7,9)(H,8,10)/t4-/m1/s1
InChIKeyQSLSTULTYMRONL-SCSAIBSYSA-N
XLogP-0.83
TPSA66.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-N,2,5-trimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine
CID 136590874
2,5-dimethyl-6-(3-phenylpropylimino)-1,2-dihydro-1,3,5-triazin-4-amine
CID 136590889
(2S)-2-methyl-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine
CID 136590856
N,N,2,5-tetramethyl-6-pentylimino-1,2-dihydro-1,3,5-triazin-4-amine
CID 136590877
1,4-dimethyl-4,5-dihydroimidazol-2-amine
CID 154143742
(4S)-1,4,5,5,6,6-hexamethyl-4H-pyrimidin-2-amine
CID 170393204
2,6-dimethyl-3,6-dihydro-2H-1,3,5-thiadiazin-4-amine
CID 12600795
2,3,5,6-tetramethyl-3,6-dihydro-1H-1,2,4-triazine
CID 129015725
2-methyl-6-[2-(4-methylthiophen-3-yl)ethylimino]-2,5-dihydro-1H-1,3,5-triazin-4-amine
CID 136591046
(2R)-2-methyl-4-N,4-N-bis(trideuteriomethyl)-1,2-dihydro-1,3,5-triazine-4,6-diamine;hydrochloride
CID 176526025
5-methyl-2,5,6,7-tetrahydro-1H-1,4-diazepin-3-amine;dihydrochloride
CID 67761525
(5R)-4-amino-5-methyl-1,5-dihydroimidazol-2-one
CID 124512317

Frequently Asked Questions

What is the IUPAC name of (2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine?
The IUPAC name of (2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine (CID 136590852) is (2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine.
What is the SMILES notation for (2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine?
The canonical SMILES for (2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine is C/N=C1\N[C@H](C)N=C(N)N1C.
What is the InChIKey of (2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine?
The InChIKey is QSLSTULTYMRONL-SCSAIBSYSA-N. The full InChI is InChI=1S/C6H13N5/c1-4-9-5(7)11(3)6(8-2)10-4/h4H,1-3H3,(H2,7,9)(H,8,10)/t4-/m1/s1.
What are the key properties of (2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine?
(2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine has a molecular weight of 155.20 g/mol, XLogP of -0.83, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2,5-dimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine is sourced from PubChem (CID 136590852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).