6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine

C17H21N3O — CID 43724739

IUPAC6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine
SMILESc1ccc(CCNc2ccc(N3CCOCC3)nc2)cc1
InChIInChI=1S/C17H21N3O/c1-2-4-15(5-3-1)8-9-18-16-6-7-17(19-14-16)20-10-12-21-13-11-20/h1-7,14,18H,8-13H2
InChIKeyKSPVAQVSAPQYFF-UHFFFAOYSA-N
MW283.38 g/mol
LogP2.57
Rot. Bonds5

About 6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine

6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine (PubChem CID 43724739) has the molecular formula C17H21N3O and a molecular weight of 283.38 g/mol. Its IUPAC name is 6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine.

Molecular Properties

Compound Name6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine
PubChem CID43724739
Molecular FormulaC17H21N3O
Molecular Weight283.38 g/mol
Exact Mass283.17
IUPAC Name6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine
SMILESc1ccc(CCNc2ccc(N3CCOCC3)nc2)cc1
InChIInChI=1S/C17H21N3O/c1-2-4-15(5-3-1)8-9-18-16-6-7-17(19-14-16)20-10-12-21-13-11-20/h1-7,14,18H,8-13H2
InChIKeyKSPVAQVSAPQYFF-UHFFFAOYSA-N
XLogP2.57
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine?
The IUPAC name of 6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine (CID 43724739) is 6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine.
What is the SMILES notation for 6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine?
The canonical SMILES for 6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine is c1ccc(CCNc2ccc(N3CCOCC3)nc2)cc1.
What is the InChIKey of 6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine?
The InChIKey is KSPVAQVSAPQYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O/c1-2-4-15(5-3-1)8-9-18-16-6-7-17(19-14-16)20-10-12-21-13-11-20/h1-7,14,18H,8-13H2.
What are the key properties of 6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine?
6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine has a molecular weight of 283.38 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-N-(2-phenylethyl)pyridin-3-amine is sourced from PubChem (CID 43724739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).