2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol

C10H18N4O — CID 105362419

IUPAC2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol
SMILESCCc1nnc(NC(C)CO)nc1CC
InChIInChI=1S/C10H18N4O/c1-4-8-9(5-2)13-14-10(12-8)11-7(3)6-15/h7,15H,4-6H2,1-3H3,(H,11,12,14)
InChIKeyRAYALZVIYFSARU-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.79
Rot. Bonds5

About 2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol

2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol (PubChem CID 105362419) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol.

Molecular Properties

Compound Name2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol
PubChem CID105362419
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol
SMILESCCc1nnc(NC(C)CO)nc1CC
InChIInChI=1S/C10H18N4O/c1-4-8-9(5-2)13-14-10(12-8)11-7(3)6-15/h7,15H,4-6H2,1-3H3,(H,11,12,14)
InChIKeyRAYALZVIYFSARU-UHFFFAOYSA-N
XLogP0.79
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.79
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]-4-methylpentan-1-ol
CID 105362502
3-N-(5,6-diethyl-1,2,4-triazin-3-yl)butane-1,3-diamine
CID 105363517
2-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1-N,1-N-diethylpropane-1,2-diamine
CID 105362578
N-[(2S)-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propyl]-2-methylpropanamide
CID 146099011
5,6-diethyl-N-pentan-3-yl-1,2,4-triazin-3-amine
CID 105362359
methyl 2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propanoate
CID 105362420
2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]-3-methylbutanoic acid
CID 105362073
2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]-3-methylbutanamide
CID 103095305
N-tert-butyl-2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propanamide
CID 105362793
5,6-diethyl-N-(1-morpholin-4-ylpropan-2-yl)-1,2,4-triazin-3-amine
CID 105362530
2-N-(5,6-diethyl-1,2,4-triazin-3-yl)-1-N,1-N,4-trimethylpentane-1,2-diamine
CID 105362544
1-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]-2-methylpentan-2-ol
CID 106544464

Frequently Asked Questions

What is the IUPAC name of 2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol?
The IUPAC name of 2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol (CID 105362419) is 2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol.
What is the SMILES notation for 2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol?
The canonical SMILES for 2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol is CCc1nnc(NC(C)CO)nc1CC.
What is the InChIKey of 2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol?
The InChIKey is RAYALZVIYFSARU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-4-8-9(5-2)13-14-10(12-8)11-7(3)6-15/h7,15H,4-6H2,1-3H3,(H,11,12,14).
What are the key properties of 2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol?
2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol has a molecular weight of 210.28 g/mol, XLogP of 0.79, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5,6-diethyl-1,2,4-triazin-3-yl)amino]propan-1-ol is sourced from PubChem (CID 105362419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).