N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine

C15H24N4O2 — CID 71872249

IUPACN-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
SMILESc1cnnc(NCC2CN(CC3CCOCC3)CCO2)c1
InChIInChI=1S/C15H24N4O2/c1-2-15(18-17-5-1)16-10-14-12-19(6-9-21-14)11-13-3-7-20-8-4-13/h1-2,5,13-14H,3-4,6-12H2,(H,16,18)
InChIKeyXFSSBXSSUYHMRY-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.02
Rot. Bonds5

About N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine

N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine (PubChem CID 71872249) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
PubChem CID71872249
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine
SMILESc1cnnc(NCC2CN(CC3CCOCC3)CCO2)c1
InChIInChI=1S/C15H24N4O2/c1-2-15(18-17-5-1)16-10-14-12-19(6-9-21-14)11-13-3-7-20-8-4-13/h1-2,5,13-14H,3-4,6-12H2,(H,16,18)
InChIKeyXFSSBXSSUYHMRY-UHFFFAOYSA-N
XLogP1.02
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine?
The IUPAC name of N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine (CID 71872249) is N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine.
What is the SMILES notation for N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine?
The canonical SMILES for N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine is c1cnnc(NCC2CN(CC3CCOCC3)CCO2)c1.
What is the InChIKey of N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine?
The InChIKey is XFSSBXSSUYHMRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-2-15(18-17-5-1)16-10-14-12-19(6-9-21-14)11-13-3-7-20-8-4-13/h1-2,5,13-14H,3-4,6-12H2,(H,16,18).
What are the key properties of N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine?
N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine has a molecular weight of 292.38 g/mol, XLogP of 1.02, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(oxan-4-ylmethyl)morpholin-2-yl]methyl]pyridazin-3-amine is sourced from PubChem (CID 71872249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).