6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine

C9H19N5 — CID 176533741

IUPAC6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine
SMILES[H]/N=C1\NC(C)N=C(N(C)CCC)N1C
InChIInChI=1S/C9H19N5/c1-5-6-13(3)9-12-7(2)11-8(10)14(9)4/h7H,5-6H2,1-4H3,(H2,10,11)
InChIKeyBQGHXNYFGIKVRT-UHFFFAOYSA-N
MW197.29 g/mol
LogP0.50
Rot. Bonds2

About 6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine

6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine (PubChem CID 176533741) has the molecular formula C9H19N5 and a molecular weight of 197.29 g/mol. Its IUPAC name is 6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine.

Molecular Properties

Compound Name6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine
PubChem CID176533741
Molecular FormulaC9H19N5
Molecular Weight197.29 g/mol
Exact Mass197.16
IUPAC Name6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine
SMILES[H]/N=C1\NC(C)N=C(N(C)CCC)N1C
InChIInChI=1S/C9H19N5/c1-5-6-13(3)9-12-7(2)11-8(10)14(9)4/h7H,5-6H2,1-4H3,(H2,10,11)
InChIKeyBQGHXNYFGIKVRT-UHFFFAOYSA-N
XLogP0.50
TPSA54.72 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.29
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine with MolForge

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Launch Full Analysis

Related Compounds

N-butyl-N,2-dimethyl-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-N-butyl-4-N,3,6-trimethyl-1,3,5-triazinane-2,4-diimine;N,2-dimethyl-6-methylimino-N-pentyl-2,5-dihydro-1H-1,3,5-triazin-4-amine;N,2-dimethyl-6-methylimino-N-propyl-2,5-dihydro-1H-1,3,5-triazin-4-amine;N-ethyl-N,2-dimethyl-6-methylimino-2,5-dihydro-1H-1,3,5-triazin-4-amine;2-N-ethyl-4-N,3,6-trimethyl-1,3,5-triazinane-2,4-diimine;6-imino-N,2,5-trimethyl-N-pentyl-1,2-dihydro-1,3,5-triazin-4-amine;4-N,3,6-trimethyl-2-N-propyl-1,3,5-triazinane-2,4-diimine
CID 176536495
N-ethyl-N,2,5-trimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine
CID 136590874
N,N,2,5-tetramethyl-6-pentylimino-1,2-dihydro-1,3,5-triazin-4-amine
CID 136590877
6-butylimino-N,N,2,5-tetramethyl-1,2-dihydro-1,3,5-triazin-4-amine;6-N-butyl-4-N,4-N,6-N,2-tetramethyl-1,2-dihydro-1,3,5-triazine-4,6-diamine;N-butyl-N,2,5-trimethyl-6-methylimino-1,2-dihydro-1,3,5-triazin-4-amine;6-ethylimino-N,N,2,5-tetramethyl-1,2-dihydro-1,3,5-triazin-4-amine;6-N-ethyl-4-N,4-N,6-N,2-tetramethyl-1,2-dihydro-1,3,5-triazine-4,6-diamine;4-N,4-N,6-N,2-tetramethyl-6-N-pentyl-1,2-dihydro-1,3,5-triazine-4,6-diamine;N,N,2,5-tetramethyl-6-pentylimino-1,2-dihydro-1,3,5-triazin-4-amine;4-N,4-N,6-N,2-tetramethyl-6-N-propyl-1,2-dihydro-1,3,5-triazine-4,6-diamine;N,N,2,5-tetramethyl-6-propylimino-1,2-dihydro-1,3,5-triazin-4-amine;N,2,5-trimethyl-6-methylimino-N-pentyl-1,2-dihydro-1,3,5-triazin-4-amine
CID 176543073
4-N-butyl-4-N,2-dimethyl-1,2-dihydro-1,3,5-triazine-4,6-diamine
CID 176533747
6-N-butyl-4-N,4-N,2-trimethyl-1,2-dihydro-1,3,5-triazine-4,6-diamine
CID 176533742
N-methyl-N-propylpyrimidin-2-amine
CID 67810585
N-[2-(3-ethyl-2-iminoimidazolidin-1-yl)ethyl]-N,1-dimethyl-5,6-dihydro-4H-pyrimidin-2-amine
CID 129059249
3-[methyl(propyl)amino]-2,5-dihydro-1,2,4-oxadiazol-5-ol
CID 123141190
N-methyl-N-propyl-2H-tetrazol-1-ium-5-amine
CID 163704264
2-imino-1-methyl-5-propylideneimidazolidin-4-one
CID 152756211
3-ethyl-5-N,1-dimethyl-5-N-propylpyrazole-4,5-diamine
CID 66014379

Frequently Asked Questions

What is the IUPAC name of 6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine?
The IUPAC name of 6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine (CID 176533741) is 6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine.
What is the SMILES notation for 6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine?
The canonical SMILES for 6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine is [H]/N=C1\NC(C)N=C(N(C)CCC)N1C.
What is the InChIKey of 6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine?
The InChIKey is BQGHXNYFGIKVRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N5/c1-5-6-13(3)9-12-7(2)11-8(10)14(9)4/h7H,5-6H2,1-4H3,(H2,10,11).
What are the key properties of 6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine?
6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine has a molecular weight of 197.29 g/mol, XLogP of 0.50, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imino-N,2,5-trimethyl-N-propyl-1,2-dihydro-1,3,5-triazin-4-amine is sourced from PubChem (CID 176533741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).