N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine

C10H16N6 — CID 136590950

IUPACN,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine
SMILESC/N=C1/NC(N(C)c2ccc[nH]2)=NC(C)N1
InChIInChI=1S/C10H16N6/c1-7-13-9(11-2)15-10(14-7)16(3)8-5-4-6-12-8/h4-7,12H,1-3H3,(H2,11,13,14,15)
InChIKeyOIKVVOQERCMCOU-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.33
Rot. Bonds1

About N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine

N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine (PubChem CID 136590950) has the molecular formula C10H16N6 and a molecular weight of 220.28 g/mol. Its IUPAC name is N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine.

Molecular Properties

Compound NameN,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine
PubChem CID136590950
Molecular FormulaC10H16N6
Molecular Weight220.28 g/mol
Exact Mass220.14
IUPAC NameN,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine
SMILESC/N=C1/NC(N(C)c2ccc[nH]2)=NC(C)N1
InChIInChI=1S/C10H16N6/c1-7-13-9(11-2)15-10(14-7)16(3)8-5-4-6-12-8/h4-7,12H,1-3H3,(H2,11,13,14,15)
InChIKeyOIKVVOQERCMCOU-UHFFFAOYSA-N
XLogP0.33
TPSA67.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine?
The IUPAC name of N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine (CID 136590950) is N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine.
What is the SMILES notation for N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine?
The canonical SMILES for N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine is C/N=C1/NC(N(C)c2ccc[nH]2)=NC(C)N1.
What is the InChIKey of N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine?
The InChIKey is OIKVVOQERCMCOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N6/c1-7-13-9(11-2)15-10(14-7)16(3)8-5-4-6-12-8/h4-7,12H,1-3H3,(H2,11,13,14,15).
What are the key properties of N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine?
N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine has a molecular weight of 220.28 g/mol, XLogP of 0.33, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-6-methylimino-N-(1H-pyrrol-2-yl)-2,5-dihydro-1H-1,3,5-triazin-4-amine is sourced from PubChem (CID 136590950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).