N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide

C14H16N4O3 — CID 109114455

IUPACN-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide
SMILESO=C(NCc1ccco1)c1ccc(N2CCOCC2)nn1
InChIInChI=1S/C14H16N4O3/c19-14(15-10-11-2-1-7-21-11)12-3-4-13(17-16-12)18-5-8-20-9-6-18/h1-4,7H,5-6,8-10H2,(H,15,19)
InChIKeyNZEIHIOQRJPVDJ-UHFFFAOYSA-N
MW288.31 g/mol
LogP0.84
Rot. Bonds4

About N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide

N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide (PubChem CID 109114455) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide
PubChem CID109114455
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC NameN-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide
SMILESO=C(NCc1ccco1)c1ccc(N2CCOCC2)nn1
InChIInChI=1S/C14H16N4O3/c19-14(15-10-11-2-1-7-21-11)12-3-4-13(17-16-12)18-5-8-20-9-6-18/h1-4,7H,5-6,8-10H2,(H,15,19)
InChIKeyNZEIHIOQRJPVDJ-UHFFFAOYSA-N
XLogP0.84
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide (CID 109114455) is N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide is O=C(NCc1ccco1)c1ccc(N2CCOCC2)nn1.
What is the InChIKey of N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide?
The InChIKey is NZEIHIOQRJPVDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c19-14(15-10-11-2-1-7-21-11)12-3-4-13(17-16-12)18-5-8-20-9-6-18/h1-4,7H,5-6,8-10H2,(H,15,19).
What are the key properties of N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide?
N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide has a molecular weight of 288.31 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide is sourced from PubChem (CID 109114455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).