4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine

C9H19N5 — CID 21027245

IUPAC4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine
SMILESCN(C)C1=NC(C(C)(C)C)N=C(N)N1
InChIInChI=1S/C9H19N5/c1-9(2,3)6-11-7(10)13-8(12-6)14(4)5/h6H,1-5H3,(H3,10,11,12,13)
InChIKeyAPXZCLOYHILTIV-UHFFFAOYSA-N
MW197.29 g/mol
LogP0.19
Rot. Bonds

About 4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine

4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine (PubChem CID 21027245) has the molecular formula C9H19N5 and a molecular weight of 197.29 g/mol. Its IUPAC name is 4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine.

Molecular Properties

Compound Name4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine
PubChem CID21027245
Molecular FormulaC9H19N5
Molecular Weight197.29 g/mol
Exact Mass197.16
IUPAC Name4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine
SMILESCN(C)C1=NC(C(C)(C)C)N=C(N)N1
InChIInChI=1S/C9H19N5/c1-9(2,3)6-11-7(10)13-8(12-6)14(4)5/h6H,1-5H3,(H3,10,11,12,13)
InChIKeyAPXZCLOYHILTIV-UHFFFAOYSA-N
XLogP0.19
TPSA66.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.29
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Launch Full Analysis

Related Compounds

Imeglimin
CID 24812808
2-Amino-3,6-dihydro-4-dimethylamino-6-methyl-1,3,5-triazine
CID 10176487
(4S)-6-N,6-N,4-trimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine
CID 46909031
6-Ethyl-N2,N2-dimethyl-3,6-dihydro-1,3,5-triazine-2,4-diamine
CID 9812867
2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine
CID 9899016
4,4-diethyl-2-N,2-N-dimethyl-1H-1,3,5-triazine-2,6-diamine
CID 21027230
4-ethyl-2-N,2-N,4-trimethyl-1H-1,3,5-triazine-2,6-diamine
CID 21027232
6-N,6-N-dimethyl-4-(2-methylpropyl)-1,4-dihydro-1,3,5-triazine-2,6-diamine
CID 21027233
6-N,6-N-dimethyl-4-propan-2-yl-1,4-dihydro-1,3,5-triazine-2,6-diamine
CID 21027234
6-N,6-N-dimethyl-4-propyl-1,4-dihydro-1,3,5-triazine-2,6-diamine
CID 21027243
2-N,2-N,6-N,6-N,4,4-hexamethyl-1H-1,3,5-triazine-2,6-diamine
CID 21027249
2-N,2-N,6-N,6-N,4-pentamethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine;hydrochloride
CID 22174774

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine?
The IUPAC name of 4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine (CID 21027245) is 4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine.
What is the SMILES notation for 4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine?
The canonical SMILES for 4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine is CN(C)C1=NC(C(C)(C)C)N=C(N)N1.
What is the InChIKey of 4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine?
The InChIKey is APXZCLOYHILTIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N5/c1-9(2,3)6-11-7(10)13-8(12-6)14(4)5/h6H,1-5H3,(H3,10,11,12,13).
What are the key properties of 4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine?
4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine has a molecular weight of 197.29 g/mol, XLogP of 0.19, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-6-N,6-N-dimethyl-1,4-dihydro-1,3,5-triazine-2,6-diamine is sourced from PubChem (CID 21027245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).