N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide

C17H18N8O3 — CID 175183943

IUPACN'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide
SMILESO=C(COc1ccnc2ccccc12)NNc1nnc(C2CNCCO2)nn1
InChIInChI=1S/C17H18N8O3/c26-15(10-28-13-5-6-19-12-4-2-1-3-11(12)13)20-23-17-24-21-16(22-25-17)14-9-18-7-8-27-14/h1-6,14,18H,7-10H2,(H,20,26)(H,23,24,25)
InChIKeyXRRYTKAKRCCEHF-UHFFFAOYSA-N
MW382.38 g/mol
LogP-0.00
Rot. Bonds6

About N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide

N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide (PubChem CID 175183943) has the molecular formula C17H18N8O3 and a molecular weight of 382.38 g/mol. Its IUPAC name is N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide.

Molecular Properties

Compound NameN'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide
PubChem CID175183943
Molecular FormulaC17H18N8O3
Molecular Weight382.38 g/mol
Exact Mass382.15
IUPAC NameN'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide
SMILESO=C(COc1ccnc2ccccc12)NNc1nnc(C2CNCCO2)nn1
InChIInChI=1S/C17H18N8O3/c26-15(10-28-13-5-6-19-12-4-2-1-3-11(12)13)20-23-17-24-21-16(22-25-17)14-9-18-7-8-27-14/h1-6,14,18H,7-10H2,(H,20,26)(H,23,24,25)
InChIKeyXRRYTKAKRCCEHF-UHFFFAOYSA-N
XLogP-0.00
TPSA136.07 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.38
LogP ≤ 5-0.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide?
The IUPAC name of N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide (CID 175183943) is N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide.
What is the SMILES notation for N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide?
The canonical SMILES for N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide is O=C(COc1ccnc2ccccc12)NNc1nnc(C2CNCCO2)nn1.
What is the InChIKey of N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide?
The InChIKey is XRRYTKAKRCCEHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N8O3/c26-15(10-28-13-5-6-19-12-4-2-1-3-11(12)13)20-23-17-24-21-16(22-25-17)14-9-18-7-8-27-14/h1-6,14,18H,7-10H2,(H,20,26)(H,23,24,25).
What are the key properties of N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide?
N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide has a molecular weight of 382.38 g/mol, XLogP of -0.00, 6 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(6-morpholin-2-yl-1,2,4,5-tetrazin-3-yl)-2-quinolin-4-yloxyacetohydrazide is sourced from PubChem (CID 175183943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).