6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine

C15H21N3O — CID 86692452

IUPAC6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine
SMILESNc1ccc(C2=CCC(N3CCOCC3)CC2)nc1
InChIInChI=1S/C15H21N3O/c16-13-3-6-15(17-11-13)12-1-4-14(5-2-12)18-7-9-19-10-8-18/h1,3,6,11,14H,2,4-5,7-10,16H2
InChIKeyHATSFKSDQOVCBO-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.93
Rot. Bonds2

About 6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine

6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine (PubChem CID 86692452) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine
PubChem CID86692452
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine
SMILESNc1ccc(C2=CCC(N3CCOCC3)CC2)nc1
InChIInChI=1S/C15H21N3O/c16-13-3-6-15(17-11-13)12-1-4-14(5-2-12)18-7-9-19-10-8-18/h1,3,6,11,14H,2,4-5,7-10,16H2
InChIKeyHATSFKSDQOVCBO-UHFFFAOYSA-N
XLogP1.93
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine?
The IUPAC name of 6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine (CID 86692452) is 6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine.
What is the SMILES notation for 6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine?
The canonical SMILES for 6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine is Nc1ccc(C2=CCC(N3CCOCC3)CC2)nc1.
What is the InChIKey of 6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine?
The InChIKey is HATSFKSDQOVCBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c16-13-3-6-15(17-11-13)12-1-4-14(5-2-12)18-7-9-19-10-8-18/h1,3,6,11,14H,2,4-5,7-10,16H2.
What are the key properties of 6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine?
6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine has a molecular weight of 259.35 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-morpholin-4-ylcyclohexen-1-yl)pyridin-3-amine is sourced from PubChem (CID 86692452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).