4-fluoro-N-methyl-3-morpholin-4-ylaniline

C11H15FN2O — CID 145213441

IUPAC4-fluoro-N-methyl-3-morpholin-4-ylaniline
SMILESCNc1ccc(F)c(N2CCOCC2)c1
InChIInChI=1S/C11H15FN2O/c1-13-9-2-3-10(12)11(8-9)14-4-6-15-7-5-14/h2-3,8,13H,4-7H2,1H3
InChIKeyDOIDWVPRDWRPKG-UHFFFAOYSA-N
MW210.25 g/mol
LogP1.70
Rot. Bonds2

About 4-fluoro-N-methyl-3-morpholin-4-ylaniline

4-fluoro-N-methyl-3-morpholin-4-ylaniline (PubChem CID 145213441) has the molecular formula C11H15FN2O and a molecular weight of 210.25 g/mol. Its IUPAC name is 4-fluoro-N-methyl-3-morpholin-4-ylaniline.

Molecular Properties

Compound Name4-fluoro-N-methyl-3-morpholin-4-ylaniline
PubChem CID145213441
Molecular FormulaC11H15FN2O
Molecular Weight210.25 g/mol
Exact Mass210.12
IUPAC Name4-fluoro-N-methyl-3-morpholin-4-ylaniline
SMILESCNc1ccc(F)c(N2CCOCC2)c1
InChIInChI=1S/C11H15FN2O/c1-13-9-2-3-10(12)11(8-9)14-4-6-15-7-5-14/h2-3,8,13H,4-7H2,1H3
InChIKeyDOIDWVPRDWRPKG-UHFFFAOYSA-N
XLogP1.70
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-fluoro-3-morpholin-4-ylphenyl)carbamoyl]butanoic acid
CID 146133334
N-ethyl-3-fluoro-4-morpholin-4-ylaniline
CID 123788462
N-[(4-fluoro-3-morpholin-4-ylphenyl)methyl]propan-1-amine
CID 84753782
4-[2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholine
CID 175593108
ethane;N-(3-fluoro-4-morpholin-4-ylphenyl)acetamide
CID 145422161
N-methyl-2-morpholin-4-ylpyridin-4-amine
CID 68914812
N-(3-fluoro-4-morpholin-4-ylphenyl)propanamide
CID 144950070
N-methyl-2-(2-morpholin-4-ylethyl)-1,3-dihydroisoindol-5-amine
CID 117006197
4-(2-fluoro-4-propan-2-ylphenyl)morpholine
CID 59216821
N-(2,2-dimethoxyethyl)-3-fluoro-4-morpholin-4-ylaniline
CID 66700439
4-[5-[4-(difluoromethoxy)phenyl]-2-fluorophenyl]morpholine
CID 70300995
N-ethylsulfanyl-4-methylcyclohexan-1-amine;N-methyl-3-morpholin-4-yl-4-(trifluoromethyl)aniline
CID 143796796

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-methyl-3-morpholin-4-ylaniline?
The IUPAC name of 4-fluoro-N-methyl-3-morpholin-4-ylaniline (CID 145213441) is 4-fluoro-N-methyl-3-morpholin-4-ylaniline.
What is the SMILES notation for 4-fluoro-N-methyl-3-morpholin-4-ylaniline?
The canonical SMILES for 4-fluoro-N-methyl-3-morpholin-4-ylaniline is CNc1ccc(F)c(N2CCOCC2)c1.
What is the InChIKey of 4-fluoro-N-methyl-3-morpholin-4-ylaniline?
The InChIKey is DOIDWVPRDWRPKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O/c1-13-9-2-3-10(12)11(8-9)14-4-6-15-7-5-14/h2-3,8,13H,4-7H2,1H3.
What are the key properties of 4-fluoro-N-methyl-3-morpholin-4-ylaniline?
4-fluoro-N-methyl-3-morpholin-4-ylaniline has a molecular weight of 210.25 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-methyl-3-morpholin-4-ylaniline is sourced from PubChem (CID 145213441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).