[4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine

C16H19N3O — CID 177019277

IUPAC[4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine
SMILESNCc1cc(-c2ccc(N3CCOCC3)cc2)ccn1
InChIInChI=1S/C16H19N3O/c17-12-15-11-14(5-6-18-15)13-1-3-16(4-2-13)19-7-9-20-10-8-19/h1-6,11H,7-10,12,17H2
InChIKeyQSGREIZOHGJRIC-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.04
Rot. Bonds3

About [4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine

[4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine (PubChem CID 177019277) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is [4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine
PubChem CID177019277
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name[4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine
SMILESNCc1cc(-c2ccc(N3CCOCC3)cc2)ccn1
InChIInChI=1S/C16H19N3O/c17-12-15-11-14(5-6-18-15)13-1-3-16(4-2-13)19-7-9-20-10-8-19/h1-6,11H,7-10,12,17H2
InChIKeyQSGREIZOHGJRIC-UHFFFAOYSA-N
XLogP2.04
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine?
The IUPAC name of [4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine (CID 177019277) is [4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine.
What is the SMILES notation for [4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine?
The canonical SMILES for [4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine is NCc1cc(-c2ccc(N3CCOCC3)cc2)ccn1.
What is the InChIKey of [4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine?
The InChIKey is QSGREIZOHGJRIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c17-12-15-11-14(5-6-18-15)13-1-3-16(4-2-13)19-7-9-20-10-8-19/h1-6,11H,7-10,12,17H2.
What are the key properties of [4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine?
[4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine has a molecular weight of 269.35 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-morpholin-4-ylphenyl)-2-pyridinyl]methanamine is sourced from PubChem (CID 177019277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).