5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine

C12H15N5 — CID 114448192

IUPAC5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine
SMILESCc1nnc(NCCc2cccnc2)nc1C
InChIInChI=1S/C12H15N5/c1-9-10(2)16-17-12(15-9)14-7-5-11-4-3-6-13-8-11/h3-4,6,8H,5,7H2,1-2H3,(H,14,15,17)
InChIKeyNNWBOXJFCXVWFA-UHFFFAOYSA-N
MW229.29 g/mol
LogP1.54
Rot. Bonds4

About 5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine

5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine (PubChem CID 114448192) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is 5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine.

Molecular Properties

Compound Name5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine
PubChem CID114448192
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine
SMILESCc1nnc(NCCc2cccnc2)nc1C
InChIInChI=1S/C12H15N5/c1-9-10(2)16-17-12(15-9)14-7-5-11-4-3-6-13-8-11/h3-4,6,8H,5,7H2,1-2H3,(H,14,15,17)
InChIKeyNNWBOXJFCXVWFA-UHFFFAOYSA-N
XLogP1.54
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5,6-dimethyl-N-(pyridin-3-ylmethyl)-1,2,4-triazin-3-amine
CID 114383128
4,6-dichloro-N-(2-pyridin-3-ylethyl)-1,3,5-triazin-2-amine
CID 58508229
N-[(2-methylpropan-2-yl)oxy]-2-pyridin-3-ylethanamine
CID 82724326
3-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]ethyl]benzoic acid
CID 114786014
5-bromo-N-(2-pyridin-3-ylethyl)pyrimidin-2-amine
CID 63873791
5,6-dimethyl-3-(2-pyridin-3-ylethylamino)pyridazine-4-carbonitrile
CID 36722480
5,6-dimethyl-N-(pyridin-4-ylmethyl)-1,2,4-triazin-3-amine
CID 114383127
4-methyl-6-phenoxy-N-(2-pyridin-3-ylethyl)pyrimidin-2-amine
CID 167757226
6-N-ethyl-2-N-(2-pyridin-3-ylethyl)pyrazine-2,6-diamine
CID 78990149
6-chloro-2-N,2-N-dimethyl-4-N-(2-pyridin-3-ylethyl)-1,3,5-triazine-2,4-diamine
CID 62864756
4-chloro-6-methoxy-N-(2-pyridin-3-ylethyl)-1,3,5-triazin-2-amine
CID 62857968
2-hydrazinyl-5-methyl-N-(2-pyridin-3-ylethyl)pyrimidin-4-amine
CID 80898668

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine?
The IUPAC name of 5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine (CID 114448192) is 5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine.
What is the SMILES notation for 5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine?
The canonical SMILES for 5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine is Cc1nnc(NCCc2cccnc2)nc1C.
What is the InChIKey of 5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine?
The InChIKey is NNWBOXJFCXVWFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-9-10(2)16-17-12(15-9)14-7-5-11-4-3-6-13-8-11/h3-4,6,8H,5,7H2,1-2H3,(H,14,15,17).
What are the key properties of 5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine?
5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine has a molecular weight of 229.29 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-N-(2-pyridin-3-ylethyl)-1,2,4-triazin-3-amine is sourced from PubChem (CID 114448192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).