N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine

C15H21N5O2 — CID 71872203

IUPACN-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
SMILESCc1nc(CN2CCOC(CNc3cccnn3)C2)oc1C
InChIInChI=1S/C15H21N5O2/c1-11-12(2)22-15(18-11)10-20-6-7-21-13(9-20)8-16-14-4-3-5-17-19-14/h3-5,13H,6-10H2,1-2H3,(H,16,19)
InChIKeyUEIVPYAAUIPEQU-UHFFFAOYSA-N
MW303.37 g/mol
LogP1.39
Rot. Bonds5

About N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine

N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine (PubChem CID 71872203) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
PubChem CID71872203
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC NameN-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
SMILESCc1nc(CN2CCOC(CNc3cccnn3)C2)oc1C
InChIInChI=1S/C15H21N5O2/c1-11-12(2)22-15(18-11)10-20-6-7-21-13(9-20)8-16-14-4-3-5-17-19-14/h3-5,13H,6-10H2,1-2H3,(H,16,19)
InChIKeyUEIVPYAAUIPEQU-UHFFFAOYSA-N
XLogP1.39
TPSA76.31 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The IUPAC name of N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine (CID 71872203) is N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine.
What is the SMILES notation for N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The canonical SMILES for N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine is Cc1nc(CN2CCOC(CNc3cccnn3)C2)oc1C.
What is the InChIKey of N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The InChIKey is UEIVPYAAUIPEQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-11-12(2)22-15(18-11)10-20-6-7-21-13(9-20)8-16-14-4-3-5-17-19-14/h3-5,13H,6-10H2,1-2H3,(H,16,19).
What are the key properties of N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine?
N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine has a molecular weight of 303.37 g/mol, XLogP of 1.39, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine is sourced from PubChem (CID 71872203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).