[4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine

C8H13N5O2 — CID 80913506

IUPAC[4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
SMILESCOc1nc(NN)nc(OCC2CC2)n1
InChIInChI=1S/C8H13N5O2/c1-14-7-10-6(13-9)11-8(12-7)15-4-5-2-3-5/h5H,2-4,9H2,1H3,(H,10,11,12,13)
InChIKeyTYIIZBQZEUQIQQ-UHFFFAOYSA-N
MW211.22 g/mol
LogP-0.05
Rot. Bonds5

About [4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine

[4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine (PubChem CID 80913506) has the molecular formula C8H13N5O2 and a molecular weight of 211.22 g/mol. Its IUPAC name is [4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
PubChem CID80913506
Molecular FormulaC8H13N5O2
Molecular Weight211.22 g/mol
Exact Mass211.11
IUPAC Name[4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
SMILESCOc1nc(NN)nc(OCC2CC2)n1
InChIInChI=1S/C8H13N5O2/c1-14-7-10-6(13-9)11-8(12-7)15-4-5-2-3-5/h5H,2-4,9H2,1H3,(H,10,11,12,13)
InChIKeyTYIIZBQZEUQIQQ-UHFFFAOYSA-N
XLogP-0.05
TPSA95.18 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[4-methoxy-6-[(3-methylcyclohexyl)methoxy]-1,3,5-triazin-2-yl]hydrazine
CID 114197438
4-(cyclopropylmethoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80867582
[4-(cyclopropylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80912453
4-(cyclohexylmethoxy)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 80925868
4-methoxy-N-methyl-6-(oxan-4-ylmethoxy)-1,3,5-triazin-2-amine
CID 80880671
N-[2-[(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)oxy]ethyl]-N-methylcyclopropanamine
CID 102741456
4-(cyclopropylmethoxy)-6-ethoxy-N-methyl-1,3,5-triazin-2-amine
CID 80867578
[4-(2,2-difluoroethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
CID 82010197
(4-cyclohexyloxy-6-methoxy-1,3,5-triazin-2-yl)hydrazine
CID 80910649
4-(cyclopropylmethoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine
CID 80865430
4-hydrazinyl-6-methoxy-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine
CID 80895205
N-(2,3-dimethylcyclopentyl)-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine
CID 80915750

Frequently Asked Questions

What is the IUPAC name of [4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine?
The IUPAC name of [4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine (CID 80913506) is [4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine.
What is the SMILES notation for [4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine?
The canonical SMILES for [4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine is COc1nc(NN)nc(OCC2CC2)n1.
What is the InChIKey of [4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine?
The InChIKey is TYIIZBQZEUQIQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O2/c1-14-7-10-6(13-9)11-8(12-7)15-4-5-2-3-5/h5H,2-4,9H2,1H3,(H,10,11,12,13).
What are the key properties of [4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine?
[4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine has a molecular weight of 211.22 g/mol, XLogP of -0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(cyclopropylmethoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine is sourced from PubChem (CID 80913506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).