N-fluoro-4-morpholin-4-ylaniline

C10H13FN2O — CID 141098997

IUPACN-fluoro-4-morpholin-4-ylaniline
SMILESFNc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C10H13FN2O/c11-12-9-1-3-10(4-2-9)13-5-7-14-8-6-13/h1-4,12H,5-8H2
InChIKeyFMYXNWGIQZTNHG-UHFFFAOYSA-N
MW196.23 g/mol
LogP1.82
Rot. Bonds2

About N-fluoro-4-morpholin-4-ylaniline

N-fluoro-4-morpholin-4-ylaniline (PubChem CID 141098997) has the molecular formula C10H13FN2O and a molecular weight of 196.23 g/mol. Its IUPAC name is N-fluoro-4-morpholin-4-ylaniline.

Molecular Properties

Compound NameN-fluoro-4-morpholin-4-ylaniline
PubChem CID141098997
Molecular FormulaC10H13FN2O
Molecular Weight196.23 g/mol
Exact Mass196.10
IUPAC NameN-fluoro-4-morpholin-4-ylaniline
SMILESFNc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C10H13FN2O/c11-12-9-1-3-10(4-2-9)13-5-7-14-8-6-13/h1-4,12H,5-8H2
InChIKeyFMYXNWGIQZTNHG-UHFFFAOYSA-N
XLogP1.82
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.23
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}

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Related Compounds

(4-morpholin-4-ylphenyl)hydrazine;hydrochloride
CID 69411327
4-morpholin-4-yl-N-phenylaniline
CID 159018746
4-(4-pyrrolidin-1-ylphenyl)morpholine
CID 67305085
13-(4-fluorophenyl)-1,4,7,10-tetraoxa-13-azacyclopentadecane
CID 102356016
N-butyl-4-morpholin-4-ylaniline
CID 28675754
1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine
CID 123306233
13-[4-[4-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)phenyl]phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane
CID 102533214
N-(3-methylbutyl)-4-morpholin-4-ylaniline
CID 28675688
N'-tert-butyl-N-(4-morpholin-4-ylphenyl)ethane-1,2-diamine
CID 107444694
N-(2,2-dimethylpropyl)-4-morpholin-4-ylaniline
CID 20785895
2-fluoro-N-(4-morpholin-4-ylphenyl)benzamide
CID 781635
4-morpholin-4-yl-N-pent-4-ynylaniline
CID 113374169

Frequently Asked Questions

What is the IUPAC name of N-fluoro-4-morpholin-4-ylaniline?
The IUPAC name of N-fluoro-4-morpholin-4-ylaniline (CID 141098997) is N-fluoro-4-morpholin-4-ylaniline.
What is the SMILES notation for N-fluoro-4-morpholin-4-ylaniline?
The canonical SMILES for N-fluoro-4-morpholin-4-ylaniline is FNc1ccc(N2CCOCC2)cc1.
What is the InChIKey of N-fluoro-4-morpholin-4-ylaniline?
The InChIKey is FMYXNWGIQZTNHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O/c11-12-9-1-3-10(4-2-9)13-5-7-14-8-6-13/h1-4,12H,5-8H2.
What are the key properties of N-fluoro-4-morpholin-4-ylaniline?
N-fluoro-4-morpholin-4-ylaniline has a molecular weight of 196.23 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-fluoro-4-morpholin-4-ylaniline is sourced from PubChem (CID 141098997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).