N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide

C15H23N3O2 — CID 3224888

IUPACN-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide
SMILESCC(=O)N(CCCN1CCOCC1)Cc1ccncc1
InChIInChI=1S/C15H23N3O2/c1-14(19)18(13-15-3-5-16-6-4-15)8-2-7-17-9-11-20-12-10-17/h3-6H,2,7-13H2,1H3
InChIKeyDBDQVGXVJAISKS-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.15
Rot. Bonds6

About N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide

N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide (PubChem CID 3224888) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide
PubChem CID3224888
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide
SMILESCC(=O)N(CCCN1CCOCC1)Cc1ccncc1
InChIInChI=1S/C15H23N3O2/c1-14(19)18(13-15-3-5-16-6-4-15)8-2-7-17-9-11-20-12-10-17/h3-6H,2,7-13H2,1H3
InChIKeyDBDQVGXVJAISKS-UHFFFAOYSA-N
XLogP1.15
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide?
The IUPAC name of N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide (CID 3224888) is N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide is CC(=O)N(CCCN1CCOCC1)Cc1ccncc1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide?
The InChIKey is DBDQVGXVJAISKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-14(19)18(13-15-3-5-16-6-4-15)8-2-7-17-9-11-20-12-10-17/h3-6H,2,7-13H2,1H3.
What are the key properties of N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide?
N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.15, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide is sourced from PubChem (CID 3224888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).