N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine

C16H20N4O — CID 68563520

IUPACN-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine
SMILESc1cncc(-c2ccc(NCCN3CCOCC3)nc2)c1
InChIInChI=1S/C16H20N4O/c1-2-14(12-17-5-1)15-3-4-16(19-13-15)18-6-7-20-8-10-21-11-9-20/h1-5,12-13H,6-11H2,(H,18,19)
InChIKeyZDLUODHMHORDIE-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.89
Rot. Bonds5

About N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine

N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine (PubChem CID 68563520) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine
PubChem CID68563520
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC NameN-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine
SMILESc1cncc(-c2ccc(NCCN3CCOCC3)nc2)c1
InChIInChI=1S/C16H20N4O/c1-2-14(12-17-5-1)15-3-4-16(19-13-15)18-6-7-20-8-10-21-11-9-20/h1-5,12-13H,6-11H2,(H,18,19)
InChIKeyZDLUODHMHORDIE-UHFFFAOYSA-N
XLogP1.89
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine?
The IUPAC name of N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine (CID 68563520) is N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine is c1cncc(-c2ccc(NCCN3CCOCC3)nc2)c1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine?
The InChIKey is ZDLUODHMHORDIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-2-14(12-17-5-1)15-3-4-16(19-13-15)18-6-7-20-8-10-21-11-9-20/h1-5,12-13H,6-11H2,(H,18,19).
What are the key properties of N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine?
N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine has a molecular weight of 284.36 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-5-pyridin-3-ylpyridin-2-amine is sourced from PubChem (CID 68563520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).