N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide

C13H23N5O — CID 105362757

IUPACN-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide
SMILESCCc1nnc(NCC(=O)NC(C)(C)C)nc1CC
InChIInChI=1S/C13H23N5O/c1-6-9-10(7-2)17-18-12(15-9)14-8-11(19)16-13(3,4)5/h6-8H2,1-5H3,(H,16,19)(H,14,15,18)
InChIKeyRDQCCGMCXONTNO-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.32
Rot. Bonds5

About N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide

N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide (PubChem CID 105362757) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide
PubChem CID105362757
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC NameN-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide
SMILESCCc1nnc(NCC(=O)NC(C)(C)C)nc1CC
InChIInChI=1S/C13H23N5O/c1-6-9-10(7-2)17-18-12(15-9)14-8-11(19)16-13(3,4)5/h6-8H2,1-5H3,(H,16,19)(H,14,15,18)
InChIKeyRDQCCGMCXONTNO-UHFFFAOYSA-N
XLogP1.32
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide
CID 105362361
N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)sulfanyl]acetamide
CID 6412044
N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propanamide
CID 105362793
3-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propanamide
CID 105362431
3-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]-3-methylbutanamide
CID 106097326
2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol
CID 105362419
5,6-diethyl-N-(4-methoxy-2,2-dimethylbutyl)-1,2,4-triazin-3-amine
CID 106545016
N-(5,6-diethyl-1,2,4-triazin-3-yl)-2-(prop-2-ynylamino)acetamide
CID 114387662
5,6-diethyl-N-(2-methylsulfanylethyl)-1,2,4-triazin-3-amine
CID 105362652
N-tert-butyl-2-[(4-ethoxypyrimidin-2-yl)amino]acetamide
CID 112638339
2-[(4-aminopyrimidin-2-yl)amino]-N-tert-butylacetamide
CID 115978168
methyl 2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propanoate
CID 105362420

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide?
The IUPAC name of N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide (CID 105362757) is N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide.
What is the SMILES notation for N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide?
The canonical SMILES for N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide is CCc1nnc(NCC(=O)NC(C)(C)C)nc1CC.
What is the InChIKey of N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide?
The InChIKey is RDQCCGMCXONTNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-6-9-10(7-2)17-18-12(15-9)14-8-11(19)16-13(3,4)5/h6-8H2,1-5H3,(H,16,19)(H,14,15,18).
What are the key properties of N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide?
N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide has a molecular weight of 265.36 g/mol, XLogP of 1.32, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]acetamide is sourced from PubChem (CID 105362757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).