4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine

C11H20N6 — CID 178081927

IUPAC4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine
SMILESCC(C)(C)NNc1ncnc(NCC2CC2)n1
InChIInChI=1S/C11H20N6/c1-11(2,3)17-16-10-14-7-13-9(15-10)12-6-8-4-5-8/h7-8,17H,4-6H2,1-3H3,(H2,12,13,14,15,16)
InChIKeyZIIGYOBIVJCMCY-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.41
Rot. Bonds5

About 4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine

4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine (PubChem CID 178081927) has the molecular formula C11H20N6 and a molecular weight of 236.32 g/mol. Its IUPAC name is 4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine
PubChem CID178081927
Molecular FormulaC11H20N6
Molecular Weight236.32 g/mol
Exact Mass236.17
IUPAC Name4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine
SMILESCC(C)(C)NNc1ncnc(NCC2CC2)n1
InChIInChI=1S/C11H20N6/c1-11(2,3)17-16-10-14-7-13-9(15-10)12-6-8-4-5-8/h7-8,17H,4-6H2,1-3H3,(H2,12,13,14,15,16)
InChIKeyZIIGYOBIVJCMCY-UHFFFAOYSA-N
XLogP1.41
TPSA74.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(cyclopropylmethyl)-4-methyl-1,3,5-triazin-2-amine
CID 91169316
2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine
CID 126972390
4-chloro-N-(cyclopropylmethyl)pyrimidin-2-amine
CID 58495643
2-N-[(1-methylazetidin-3-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 131025917
N-(cyclopropylmethyl)-5-iodopyrimidin-2-amine
CID 115620662
N-(cyclopentylmethyl)-4,6-dimethoxypyrimidin-2-amine
CID 113278339
5-bromo-N-[(4-chlorocyclohexyl)methyl]pyrimidin-2-amine
CID 106126066
4-N-methyl-2-N-[(1-methylpyrrolidin-2-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 142876099
4,6-dimethyl-N-[[4-(trifluoromethyl)cyclohexyl]methyl]pyrimidin-2-amine
CID 123277786
N-(cyclopentylmethyl)-4-methoxypyrimidin-2-amine
CID 112684482
N-(cyclopropylmethyl)-6-(fluoromethyl)pyrimidin-4-amine
CID 126849132
N-(cyclopentylmethyl)pyrimidin-2-amine
CID 43317116

Frequently Asked Questions

What is the IUPAC name of 4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine (CID 178081927) is 4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine is CC(C)(C)NNc1ncnc(NCC2CC2)n1.
What is the InChIKey of 4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine?
The InChIKey is ZIIGYOBIVJCMCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6/c1-11(2,3)17-16-10-14-7-13-9(15-10)12-6-8-4-5-8/h7-8,17H,4-6H2,1-3H3,(H2,12,13,14,15,16).
What are the key properties of 4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine?
4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine has a molecular weight of 236.32 g/mol, XLogP of 1.41, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 178081927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).