N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine

C16H18FN3O — CID 43724722

IUPACN-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine
SMILESFc1ccc(CNc2ccc(N3CCOCC3)nc2)cc1
InChIInChI=1S/C16H18FN3O/c17-14-3-1-13(2-4-14)11-18-15-5-6-16(19-12-15)20-7-9-21-10-8-20/h1-6,12,18H,7-11H2
InChIKeyMXHAGSGLRNQQSM-UHFFFAOYSA-N
MW287.34 g/mol
LogP2.67
Rot. Bonds4

About N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine

N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine (PubChem CID 43724722) has the molecular formula C16H18FN3O and a molecular weight of 287.34 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine
PubChem CID43724722
Molecular FormulaC16H18FN3O
Molecular Weight287.34 g/mol
Exact Mass287.14
IUPAC NameN-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine
SMILESFc1ccc(CNc2ccc(N3CCOCC3)nc2)cc1
InChIInChI=1S/C16H18FN3O/c17-14-3-1-13(2-4-14)11-18-15-5-6-16(19-12-15)20-7-9-21-10-8-20/h1-6,12,18H,7-11H2
InChIKeyMXHAGSGLRNQQSM-UHFFFAOYSA-N
XLogP2.67
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine?
The IUPAC name of N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine (CID 43724722) is N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine is Fc1ccc(CNc2ccc(N3CCOCC3)nc2)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine?
The InChIKey is MXHAGSGLRNQQSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O/c17-14-3-1-13(2-4-14)11-18-15-5-6-16(19-12-15)20-7-9-21-10-8-20/h1-6,12,18H,7-11H2.
What are the key properties of N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine?
N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine has a molecular weight of 287.34 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-6-morpholin-4-ylpyridin-3-amine is sourced from PubChem (CID 43724722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).