N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine

C15H20N4 — CID 86220386

IUPACN-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine
SMILESCc1nc(NCc2ccccc2)nc(C(C)(C)C)n1
InChIInChI=1S/C15H20N4/c1-11-17-13(15(2,3)4)19-14(18-11)16-10-12-8-6-5-7-9-12/h5-9H,10H2,1-4H3,(H,16,17,18,19)
InChIKeyWETLSYUMOZDVNM-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.09
Rot. Bonds3

About N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine

N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine (PubChem CID 86220386) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine
PubChem CID86220386
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC NameN-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine
SMILESCc1nc(NCc2ccccc2)nc(C(C)(C)C)n1
InChIInChI=1S/C15H20N4/c1-11-17-13(15(2,3)4)19-14(18-11)16-10-12-8-6-5-7-9-12/h5-9H,10H2,1-4H3,(H,16,17,18,19)
InChIKeyWETLSYUMOZDVNM-UHFFFAOYSA-N
XLogP3.09
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

2-N,4-N,6-N-tribenzyl-1,3,5-triazine-2,4,6-triamine
CID 11372871
2-N-benzyl-4-N,6-N-diethyl-1,3,5-triazine-2,4,6-triamine
CID 7589426
N-benzyl-4-methyl-6-phenylpyrimidin-2-amine
CID 13126867
4-N-benzyl-2-N-(2-methylprop-2-enyl)-1,3,5-triazine-2,4,6-triamine
CID 54014902
N-benzyl-2-methyl-6-phenylpyrimidin-4-amine
CID 16957885
5-benzyl-3-tert-butyl-1H-1,2,4-triazole
CID 163550877
N-benzyl-4,6-bis(3-methylbutyl)pyrimidin-2-amine
CID 25130562
N-benzyl-N'-(4,6-dimethylpyrimidin-2-yl)ethane-1,2-diamine
CID 102536498
ethyl 2-[[4-(benzylamino)-6-chloro-1,3,5-triazin-2-yl]amino]acetate
CID 779533
N-benzyl-4,6-bis(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-1,3,5-triazin-2-amine
CID 571775
2-N,4-N-dibenzylpyrimidine-2,4,6-triamine
CID 100996925
N-benzyl-4,6-dimethylpyridin-2-amine
CID 14593016

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine?
The IUPAC name of N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine (CID 86220386) is N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine is Cc1nc(NCc2ccccc2)nc(C(C)(C)C)n1.
What is the InChIKey of N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine?
The InChIKey is WETLSYUMOZDVNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-11-17-13(15(2,3)4)19-14(18-11)16-10-12-8-6-5-7-9-12/h5-9H,10H2,1-4H3,(H,16,17,18,19).
What are the key properties of N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine?
N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine has a molecular weight of 256.35 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-tert-butyl-6-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 86220386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).