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

C15H21N5O2 — CID 97004851

IUPACN-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
SMILESCc1cc(CN2CCO[C@@H](CN(C)c3cccnn3)C2)no1
InChIInChI=1S/C15H21N5O2/c1-12-8-13(18-22-12)9-20-6-7-21-14(11-20)10-19(2)15-4-3-5-16-17-15/h3-5,8,14H,6-7,9-11H2,1-2H3/t14-/m0/s1
InChIKeyXNGYWLBRXDYQDF-AWEZNQCLSA-N
MW303.37 g/mol
LogP1.11
Rot. Bonds5

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

N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine (PubChem CID 97004851) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
PubChem CID97004851
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC NameN-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
SMILESCc1cc(CN2CCO[C@@H](CN(C)c3cccnn3)C2)no1
InChIInChI=1S/C15H21N5O2/c1-12-8-13(18-22-12)9-20-6-7-21-14(11-20)10-19(2)15-4-3-5-16-17-15/h3-5,8,14H,6-7,9-11H2,1-2H3/t14-/m0/s1
InChIKeyXNGYWLBRXDYQDF-AWEZNQCLSA-N
XLogP1.11
TPSA67.52 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The IUPAC name of N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine (CID 97004851) is N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine.
What is the SMILES notation for N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The canonical SMILES for N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine is Cc1cc(CN2CCO[C@@H](CN(C)c3cccnn3)C2)no1.
What is the InChIKey of N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine?
The InChIKey is XNGYWLBRXDYQDF-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-12-8-13(18-22-12)9-20-6-7-21-14(11-20)10-19(2)15-4-3-5-16-17-15/h3-5,8,14H,6-7,9-11H2,1-2H3/t14-/m0/s1.
What are the key properties of N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine?
N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine has a molecular weight of 303.37 g/mol, XLogP of 1.11, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine is sourced from PubChem (CID 97004851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).