N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine

C18H23FN4O2 — CID 96998271

IUPACN-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine
SMILESCN(C[C@H]1CN(CCOc2cccc(F)c2)CCO1)c1cccnn1
InChIInChI=1S/C18H23FN4O2/c1-22(18-6-3-7-20-21-18)13-17-14-23(9-11-25-17)8-10-24-16-5-2-4-15(19)12-16/h2-7,12,17H,8-11,13-14H2,1H3/t17-/m0/s1
InChIKeyDZFBLSSWWZVBSG-KRWDZBQOSA-N
MW346.41 g/mol
LogP1.83
Rot. Bonds7

About N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine

N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine (PubChem CID 96998271) has the molecular formula C18H23FN4O2 and a molecular weight of 346.41 g/mol. Its IUPAC name is N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine.

Molecular Properties

Compound NameN-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine
PubChem CID96998271
Molecular FormulaC18H23FN4O2
Molecular Weight346.41 g/mol
Exact Mass346.18
IUPAC NameN-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine
SMILESCN(C[C@H]1CN(CCOc2cccc(F)c2)CCO1)c1cccnn1
InChIInChI=1S/C18H23FN4O2/c1-22(18-6-3-7-20-21-18)13-17-14-23(9-11-25-17)8-10-24-16-5-2-4-15(19)12-16/h2-7,12,17H,8-11,13-14H2,1H3/t17-/m0/s1
InChIKeyDZFBLSSWWZVBSG-KRWDZBQOSA-N
XLogP1.83
TPSA50.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.41
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-[[(2S)-4-[(2-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine
CID 96998292
N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 167853689
N-methyl-N-[[(2S)-4-[2-(1,2,4-triazol-1-yl)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 96998278
2-[2-[[methyl(pyridazin-3-yl)amino]methyl]morpholin-4-yl]acetamide
CID 71872661
N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 97004851
3-[(2S)-2-[[methyl(pyridazin-3-yl)amino]methyl]morpholin-4-yl]-1-piperidin-1-ylpropan-1-one
CID 96998264
N-[[4-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine
CID 71872633
N-(5-methyl-1,2-oxazol-3-yl)-2-[2-[[methyl(pyridazin-3-yl)amino]methyl]morpholin-4-yl]acetamide
CID 71872628
2-(3-bromophenyl)-4-[2-(3-fluorophenoxy)ethyl]morpholine
CID 60609509
N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine
CID 71928443
N-[[(2S)-4-[(1R)-1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine
CID 97021534
1-[(2R)-4-[2-(2-methoxyphenoxy)ethyl]morpholin-2-yl]-N,N-dimethylmethanamine
CID 95347452

Frequently Asked Questions

What is the IUPAC name of N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine?
The IUPAC name of N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine (CID 96998271) is N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine.
What is the SMILES notation for N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine?
The canonical SMILES for N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine is CN(C[C@H]1CN(CCOc2cccc(F)c2)CCO1)c1cccnn1.
What is the InChIKey of N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine?
The InChIKey is DZFBLSSWWZVBSG-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H23FN4O2/c1-22(18-6-3-7-20-21-18)13-17-14-23(9-11-25-17)8-10-24-16-5-2-4-15(19)12-16/h2-7,12,17H,8-11,13-14H2,1H3/t17-/m0/s1.
What are the key properties of N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine?
N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine has a molecular weight of 346.41 g/mol, XLogP of 1.83, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R)-4-[2-(3-fluorophenoxy)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine is sourced from PubChem (CID 96998271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).