[4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine

C15H19FN4O — CID 120844523

IUPAC[4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine
SMILESNCC1CN(Cc2ccnn2-c2ccc(F)cc2)CCO1
InChIInChI=1S/C15H19FN4O/c16-12-1-3-13(4-2-12)20-14(5-6-18-20)10-19-7-8-21-15(9-17)11-19/h1-6,15H,7-11,17H2
InChIKeyGKSAETHYQLIKNE-UHFFFAOYSA-N
MW290.34 g/mol
LogP1.17
Rot. Bonds4

About [4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine

[4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine (PubChem CID 120844523) has the molecular formula C15H19FN4O and a molecular weight of 290.34 g/mol. Its IUPAC name is [4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine
PubChem CID120844523
Molecular FormulaC15H19FN4O
Molecular Weight290.34 g/mol
Exact Mass290.15
IUPAC Name[4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine
SMILESNCC1CN(Cc2ccnn2-c2ccc(F)cc2)CCO1
InChIInChI=1S/C15H19FN4O/c16-12-1-3-13(4-2-12)20-14(5-6-18-20)10-19-7-8-21-15(9-17)11-19/h1-6,15H,7-11,17H2
InChIKeyGKSAETHYQLIKNE-UHFFFAOYSA-N
XLogP1.17
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-[(2-propylpyrazol-3-yl)methyl]morpholin-2-yl]methanamine
CID 114556434
1-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]piperidin-3-amine;hydrochloride
CID 120834889
[2-(4-fluorophenyl)pyrazol-3-yl]methanamine
CID 83877731
3-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]-3,9-diazabicyclo[3.3.1]nonane
CID 120845762
[4-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]morpholin-2-yl]methanamine
CID 114393433
[4-[(4-methyl-3-pyridinyl)methyl]morpholin-2-yl]methanamine;hydrochloride
CID 120844442
[4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]methanamine
CID 10308229
[(2R)-4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]methanamine
CID 11346392
(2R)-2-[(4-fluorophenyl)methyl]-4-(1H-imidazol-2-ylmethyl)morpholine
CID 124966375
[4-[(4-propan-2-ylphenyl)methyl]morpholin-2-yl]methanamine
CID 61338959
[4-[(2-chloro-4-pyridinyl)methyl]morpholin-2-yl]methanamine
CID 114394884
[4-[(4-chloro-2-fluorophenyl)methyl]morpholin-2-yl]methanamine;hydrochloride
CID 120844387

Frequently Asked Questions

What is the IUPAC name of [4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine?
The IUPAC name of [4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine (CID 120844523) is [4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine.
What is the SMILES notation for [4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine?
The canonical SMILES for [4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine is NCC1CN(Cc2ccnn2-c2ccc(F)cc2)CCO1.
What is the InChIKey of [4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine?
The InChIKey is GKSAETHYQLIKNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN4O/c16-12-1-3-13(4-2-12)20-14(5-6-18-20)10-19-7-8-21-15(9-17)11-19/h1-6,15H,7-11,17H2.
What are the key properties of [4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine?
[4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine has a molecular weight of 290.34 g/mol, XLogP of 1.17, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[2-(4-fluorophenyl)pyrazol-3-yl]methyl]morpholin-2-yl]methanamine is sourced from PubChem (CID 120844523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).