[2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine

C14H21N5O — CID 105279057

IUPAC[2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine
SMILESCCCn1nncc1C(NN)C(OC)c1ccccc1
InChIInChI=1S/C14H21N5O/c1-3-9-19-12(10-16-18-19)13(17-15)14(20-2)11-7-5-4-6-8-11/h4-8,10,13-14,17H,3,9,15H2,1-2H3
InChIKeyJKOLVUQMKSDNCV-UHFFFAOYSA-N
MW275.36 g/mol
LogP1.58
Rot. Bonds7

About [2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine

[2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine (PubChem CID 105279057) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is [2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine
PubChem CID105279057
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name[2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine
SMILESCCCn1nncc1C(NN)C(OC)c1ccccc1
InChIInChI=1S/C14H21N5O/c1-3-9-19-12(10-16-18-19)13(17-15)14(20-2)11-7-5-4-6-8-11/h4-8,10,13-14,17H,3,9,15H2,1-2H3
InChIKeyJKOLVUQMKSDNCV-UHFFFAOYSA-N
XLogP1.58
TPSA77.99 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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

[1-(4-bromo-1-propylpyrazol-5-yl)-2-methoxy-2-phenylethyl]hydrazine
CID 105279178
[2-cyclopropyl-1-(3-propyltriazol-4-yl)propyl]hydrazine
CID 105335544
[(2-chloro-4-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105252709
[(4-bromophenyl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105192382
[2-(2-chlorophenyl)sulfanyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine
CID 105237633
N-ethyl-2-methoxy-2-phenyl-1-(1-propylpyrazol-4-yl)ethanamine
CID 116773141
[(6-chloro-3-pyridinyl)-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105253024
[1-(furan-3-yl)-2-methoxy-2-phenylethyl]hydrazine
CID 105279158
(1S)-2-methoxy-1-(3-propyltriazol-4-yl)ethanamine
CID 165459865
1-(3-propyltriazol-4-yl)ethanamine
CID 114687009
[7-bicyclo[4.2.0]octa-1,3,5-trienyl-(3-propyltriazol-4-yl)methyl]hydrazine
CID 105224717
1-phenyl-N-(3-propyltriazol-4-yl)ethane-1,2-diamine
CID 114223486

Frequently Asked Questions

What is the IUPAC name of [2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine?
The IUPAC name of [2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine (CID 105279057) is [2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine.
What is the SMILES notation for [2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine?
The canonical SMILES for [2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine is CCCn1nncc1C(NN)C(OC)c1ccccc1.
What is the InChIKey of [2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine?
The InChIKey is JKOLVUQMKSDNCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-3-9-19-12(10-16-18-19)13(17-15)14(20-2)11-7-5-4-6-8-11/h4-8,10,13-14,17H,3,9,15H2,1-2H3.
What are the key properties of [2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine?
[2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine has a molecular weight of 275.36 g/mol, XLogP of 1.58, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxy-2-phenyl-1-(3-propyltriazol-4-yl)ethyl]hydrazine is sourced from PubChem (CID 105279057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).