N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine

C15H29N5 — CID 105362365

IUPACN-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
SMILESCCc1nnc(NCCN(C(C)C)C(C)C)nc1CC
InChIInChI=1S/C15H29N5/c1-7-13-14(8-2)18-19-15(17-13)16-9-10-20(11(3)4)12(5)6/h11-12H,7-10H2,1-6H3,(H,16,17,19)
InChIKeyMCPYBBORGXULLD-UHFFFAOYSA-N
MW279.43 g/mol
LogP2.53
Rot. Bonds8

About N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine

N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine (PubChem CID 105362365) has the molecular formula C15H29N5 and a molecular weight of 279.43 g/mol. Its IUPAC name is N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
PubChem CID105362365
Molecular FormulaC15H29N5
Molecular Weight279.43 g/mol
Exact Mass279.24
IUPAC NameN-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
SMILESCCc1nnc(NCCN(C(C)C)C(C)C)nc1CC
InChIInChI=1S/C15H29N5/c1-7-13-14(8-2)18-19-15(17-13)16-9-10-20(11(3)4)12(5)6/h11-12H,7-10H2,1-6H3,(H,16,17,19)
InChIKeyMCPYBBORGXULLD-UHFFFAOYSA-N
XLogP2.53
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine with MolForge

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Related Compounds

1-N-(5,6-diethyl-1,2,4-triazin-3-yl)butane-1,3-diamine
CID 105362989
N-(2-chloroethyl)-5,6-diethyl-1,2,4-triazin-3-amine
CID 105363386
5,6-diethyl-N-(2-methylsulfanylethyl)-1,2,4-triazin-3-amine
CID 105362652
5,6-diethyl-N-octyl-1,2,4-triazin-3-amine
CID 105362763
N-[3-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propyl]-N-ethylmethanesulfonamide
CID 105362475
N'-(5,6-diethyl-1,2,4-triazin-3-yl)butane-1,4-diamine
CID 105362304
N-but-3-ynyl-5,6-diethyl-1,2,4-triazin-3-amine
CID 105362658
N-(4,6-dichloro-1,3,5-triazin-2-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 60726247
3-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propanamide
CID 105362431
4-[2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]ethyl]phenol
CID 105362499
2-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1-N,1-N-diethylpropane-1,2-diamine
CID 105362578
1-N-(5,6-diethyl-1,2,4-triazin-3-yl)-4-methoxybutane-1,3-diamine
CID 114163207

Frequently Asked Questions

What is the IUPAC name of N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine?
The IUPAC name of N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine (CID 105362365) is N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine?
The canonical SMILES for N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine is CCc1nnc(NCCN(C(C)C)C(C)C)nc1CC.
What is the InChIKey of N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine?
The InChIKey is MCPYBBORGXULLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N5/c1-7-13-14(8-2)18-19-15(17-13)16-9-10-20(11(3)4)12(5)6/h11-12H,7-10H2,1-6H3,(H,16,17,19).
What are the key properties of N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine?
N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine has a molecular weight of 279.43 g/mol, XLogP of 2.53, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-diethyl-1,2,4-triazin-3-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 105362365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).