1-tert-butyl-2-methyl-2H-1,3,5-triazine

C8H15N3 — CID 142193079

IUPAC1-tert-butyl-2-methyl-2H-1,3,5-triazine
SMILESCC1N=CN=CN1C(C)(C)C
InChIInChI=1S/C8H15N3/c1-7-10-5-9-6-11(7)8(2,3)4/h5-7H,1-4H3
InChIKeyHZANQYZMNVSVRU-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.50
Rot. Bonds

About 1-tert-butyl-2-methyl-2H-1,3,5-triazine

1-tert-butyl-2-methyl-2H-1,3,5-triazine (PubChem CID 142193079) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 1-tert-butyl-2-methyl-2H-1,3,5-triazine.

Molecular Properties

Compound Name1-tert-butyl-2-methyl-2H-1,3,5-triazine
PubChem CID142193079
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name1-tert-butyl-2-methyl-2H-1,3,5-triazine
SMILESCC1N=CN=CN1C(C)(C)C
InChIInChI=1S/C8H15N3/c1-7-10-5-9-6-11(7)8(2,3)4/h5-7H,1-4H3
InChIKeyHZANQYZMNVSVRU-UHFFFAOYSA-N
XLogP1.50
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Tert-butyl-1,1,3,3-tetraethylguanidine
CID 12820357
1-Tert-butyl-1,2,3,3-tetraethylguanidine
CID 19385148
1-tert-butyl-5,6-dihydro-4H-pyrimidine
CID 20202172
N'-tert-butyl-N,N-diethylmethanimidamide
CID 58319947
N,N-ditert-butyl-N'-methylmethanimidamide
CID 58319996
N-tert-butyl-N-ethyl-N'-methylmethanimidamide
CID 58320043
N'-tert-butyl-N-ethyl-N-methylmethanimidamide
CID 58320080
N-tert-butyl-N'-methyl-N-propan-2-ylmethanimidamide
CID 58320128
[[Tert-butyl(ethyl)amino]-(dimethylamino)methylidene]-dimethylazanium
CID 58320153
[(Ditert-butylamino)-(dimethylamino)methylidene]-dimethylazanium
CID 58320197
1-Tert-butyl-1,3,3-triethyl-2-methylguanidine
CID 58320218
1-tert-butyl-1-ethyl-2-methylsulfanyl-2H-1,3,5-triazin-1-ium
CID 66728291

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-2-methyl-2H-1,3,5-triazine?
The IUPAC name of 1-tert-butyl-2-methyl-2H-1,3,5-triazine (CID 142193079) is 1-tert-butyl-2-methyl-2H-1,3,5-triazine.
What is the SMILES notation for 1-tert-butyl-2-methyl-2H-1,3,5-triazine?
The canonical SMILES for 1-tert-butyl-2-methyl-2H-1,3,5-triazine is CC1N=CN=CN1C(C)(C)C.
What is the InChIKey of 1-tert-butyl-2-methyl-2H-1,3,5-triazine?
The InChIKey is HZANQYZMNVSVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-7-10-5-9-6-11(7)8(2,3)4/h5-7H,1-4H3.
What are the key properties of 1-tert-butyl-2-methyl-2H-1,3,5-triazine?
1-tert-butyl-2-methyl-2H-1,3,5-triazine has a molecular weight of 153.23 g/mol, XLogP of 1.50, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-2-methyl-2H-1,3,5-triazine is sourced from PubChem (CID 142193079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).