(4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine

C11H19N5O2 — CID 80909474

IUPAC(4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine
SMILESCCCOc1nc(NN)nc(OC2CCCC2)n1
InChIInChI=1S/C11H19N5O2/c1-2-7-17-10-13-9(16-12)14-11(15-10)18-8-5-3-4-6-8/h8H,2-7,12H2,1H3,(H,13,14,15,16)
InChIKeyNUKJDPGMHGUCEM-UHFFFAOYSA-N
MW253.31 g/mol
LogP1.27
Rot. Bonds6

About (4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine

(4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine (PubChem CID 80909474) has the molecular formula C11H19N5O2 and a molecular weight of 253.31 g/mol. Its IUPAC name is (4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine.

Molecular Properties

Compound Name(4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine
PubChem CID80909474
Molecular FormulaC11H19N5O2
Molecular Weight253.31 g/mol
Exact Mass253.15
IUPAC Name(4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine
SMILESCCCOc1nc(NN)nc(OC2CCCC2)n1
InChIInChI=1S/C11H19N5O2/c1-2-7-17-10-13-9(16-12)14-11(15-10)18-8-5-3-4-6-8/h8H,2-7,12H2,1H3,(H,13,14,15,16)
InChIKeyNUKJDPGMHGUCEM-UHFFFAOYSA-N
XLogP1.27
TPSA95.18 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 51.27
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-(3-methoxycyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80924501
[4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80921167
[4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80925332
4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine
CID 80872035
[4-(cyclopropylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80912453
(4-cyclohexyloxy-6-methoxy-1,3,5-triazin-2-yl)hydrazine
CID 80910649
N-(1-cyclopentylethyl)-4-hydrazinyl-6-propoxy-1,3,5-triazin-2-amine
CID 80911202
4-cycloheptyloxy-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine
CID 80913301
4-hydrazinyl-N-(2-methylcycloheptyl)-6-propoxy-1,3,5-triazin-2-amine
CID 80925892
4-cycloheptyloxy-6-ethoxy-N-methyl-1,3,5-triazin-2-amine
CID 80871773
[4-(3-methylbutoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80909820
N-(2-cyclopropylpropan-2-yl)-4-hydrazinyl-6-propoxy-1,3,5-triazin-2-amine
CID 114112716

Frequently Asked Questions

What is the IUPAC name of (4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine?
The IUPAC name of (4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine (CID 80909474) is (4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine.
What is the SMILES notation for (4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine?
The canonical SMILES for (4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine is CCCOc1nc(NN)nc(OC2CCCC2)n1.
What is the InChIKey of (4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine?
The InChIKey is NUKJDPGMHGUCEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O2/c1-2-7-17-10-13-9(16-12)14-11(15-10)18-8-5-3-4-6-8/h8H,2-7,12H2,1H3,(H,13,14,15,16).
What are the key properties of (4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine?
(4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine has a molecular weight of 253.31 g/mol, XLogP of 1.27, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine is sourced from PubChem (CID 80909474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).