6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine

C12H17N5 — CID 130258017

IUPAC6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine
SMILESCc1cccc(NC2=NCN=C(N(C)C)N2)c1
InChIInChI=1S/C12H17N5/c1-9-5-4-6-10(7-9)15-11-13-8-14-12(16-11)17(2)3/h4-7H,8H2,1-3H3,(H2,13,14,15,16)
InChIKeyHAGUNFIMWXSOBG-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.24
Rot. Bonds1

About 6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine

6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine (PubChem CID 130258017) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is 6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine.

Molecular Properties

Compound Name6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine
PubChem CID130258017
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC Name6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine
SMILESCc1cccc(NC2=NCN=C(N(C)C)N2)c1
InChIInChI=1S/C12H17N5/c1-9-5-4-6-10(7-9)15-11-13-8-14-12(16-11)17(2)3/h4-7H,8H2,1-3H3,(H2,13,14,15,16)
InChIKeyHAGUNFIMWXSOBG-UHFFFAOYSA-N
XLogP1.24
TPSA52.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine with MolForge

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Related Compounds

5-methyl-N-(3-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 126982467
4-N-(3-methylphenyl)-1,3,5-triazaspiro[5.5]undeca-1,4-diene-2,4-diamine
CID 879244
6-(3-methylanilino)-2,4-dihydroimidazo[4,5-b]pyridin-5-one
CID 159330375
2-N-(4-methoxyphenyl)-4-N,6-N-bis(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,4,6-triamine
CID 123458693
4-chloro-N-(3-methylphenyl)-1,4-dihydropyrimidin-2-amine
CID 89312174
N-(3-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 7059356
N-(3-methylphenyl)-1H-pyrazol-5-amine
CID 90800192
5-cyclopropyl-N-(3-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63296653
6-[2-(4-chlorophenyl)ethylimino]-N,N,2-trimethyl-2,5-dihydro-1H-1,3,5-triazin-4-amine;6-[(4-chlorophenyl)methylimino]-N,N,2-trimethyl-2,5-dihydro-1H-1,3,5-triazin-4-amine;ethane;methane;6-N,6-N,4-trimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine
CID 158326867
1,1'-biphenyl;3-methyl-N-phenylaniline
CID 19838437
5-N-(4-fluorophenyl)-5-N-methyl-2-N-(3-methylphenyl)pyrimidine-2,5-diamine
CID 71289636
4,6-difluoro-N-(3-methylphenyl)pyrimidin-2-amine
CID 613301

Frequently Asked Questions

What is the IUPAC name of 6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine?
The IUPAC name of 6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine (CID 130258017) is 6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine.
What is the SMILES notation for 6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine?
The canonical SMILES for 6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine is Cc1cccc(NC2=NCN=C(N(C)C)N2)c1.
What is the InChIKey of 6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine?
The InChIKey is HAGUNFIMWXSOBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c1-9-5-4-6-10(7-9)15-11-13-8-14-12(16-11)17(2)3/h4-7H,8H2,1-3H3,(H2,13,14,15,16).
What are the key properties of 6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine?
6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine has a molecular weight of 231.30 g/mol, XLogP of 1.24, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,6-N-dimethyl-2-N-(3-methylphenyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine is sourced from PubChem (CID 130258017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).