[1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol

C10H16N4O — CID 114448681

IUPAC[1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol
SMILESCc1nnc(NCC2(CO)CC2)nc1C
InChIInChI=1S/C10H16N4O/c1-7-8(2)13-14-9(12-7)11-5-10(6-15)3-4-10/h15H,3-6H2,1-2H3,(H,11,12,14)
InChIKeyNNKMSUALLNDEGB-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.67
Rot. Bonds4

About [1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol

[1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol (PubChem CID 114448681) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is [1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol
PubChem CID114448681
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name[1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol
SMILESCc1nnc(NCC2(CO)CC2)nc1C
InChIInChI=1S/C10H16N4O/c1-7-8(2)13-14-9(12-7)11-5-10(6-15)3-4-10/h15H,3-6H2,1-2H3,(H,11,12,14)
InChIKeyNNKMSUALLNDEGB-UHFFFAOYSA-N
XLogP0.67
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[1-(chloromethyl)cyclohexyl]methyl]-5,6-dimethyl-1,2,4-triazin-3-amine
CID 114787922
[1-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]cyclobutyl]methanol
CID 114448760
3-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]oxolan-3-ol
CID 104925043
4-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]but-2-yn-1-ol
CID 130657687
[1-[[(6-methylpyridazin-3-yl)amino]methyl]cyclopropyl]methanol
CID 115455152
[1-[[(4-amino-6-methyl-1,3,5-triazin-2-yl)amino]methyl]cyclohexyl]methanol
CID 112746327
[1-[[(4-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol
CID 115455218
2-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]acetamide
CID 114448156
N-(5,6-dimethyl-1,2,4-triazin-3-yl)-N',N'-dimethylethane-1,2-diamine
CID 23349917
3-[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]-2,2-dimethylpropanoic acid
CID 114786134
[1-[[(6-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]cyclopropyl]methanol
CID 113313323
2-[[1-(hydroxymethyl)cyclopropyl]methylamino]-5,6-dimethylpyridine-3-carboxamide
CID 131918603

Frequently Asked Questions

What is the IUPAC name of [1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol?
The IUPAC name of [1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol (CID 114448681) is [1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol is Cc1nnc(NCC2(CO)CC2)nc1C.
What is the InChIKey of [1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol?
The InChIKey is NNKMSUALLNDEGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-7-8(2)13-14-9(12-7)11-5-10(6-15)3-4-10/h15H,3-6H2,1-2H3,(H,11,12,14).
What are the key properties of [1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol?
[1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol has a molecular weight of 208.26 g/mol, XLogP of 0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(5,6-dimethyl-1,2,4-triazin-3-yl)amino]methyl]cyclopropyl]methanol is sourced from PubChem (CID 114448681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).