N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide

C20H26N4O2 — CID 83273950

IUPACN-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide
SMILESCN(CCc1ccccn1)C(=O)CCc1ccnc(N2CCOCC2)c1
InChIInChI=1S/C20H26N4O2/c1-23(11-8-18-4-2-3-9-21-18)20(25)6-5-17-7-10-22-19(16-17)24-12-14-26-15-13-24/h2-4,7,9-10,16H,5-6,8,11-15H2,1H3
InChIKeyXJJWSTPDXAEIHV-UHFFFAOYSA-N
MW354.45 g/mol
LogP1.95
Rot. Bonds7

About N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide

N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide (PubChem CID 83273950) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide.

Molecular Properties

Compound NameN-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide
PubChem CID83273950
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC NameN-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide
SMILESCN(CCc1ccccn1)C(=O)CCc1ccnc(N2CCOCC2)c1
InChIInChI=1S/C20H26N4O2/c1-23(11-8-18-4-2-3-9-21-18)20(25)6-5-17-7-10-22-19(16-17)24-12-14-26-15-13-24/h2-4,7,9-10,16H,5-6,8,11-15H2,1H3
InChIKeyXJJWSTPDXAEIHV-UHFFFAOYSA-N
XLogP1.95
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide?
The IUPAC name of N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide (CID 83273950) is N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide.
What is the SMILES notation for N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide?
The canonical SMILES for N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide is CN(CCc1ccccn1)C(=O)CCc1ccnc(N2CCOCC2)c1.
What is the InChIKey of N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide?
The InChIKey is XJJWSTPDXAEIHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-23(11-8-18-4-2-3-9-21-18)20(25)6-5-17-7-10-22-19(16-17)24-12-14-26-15-13-24/h2-4,7,9-10,16H,5-6,8,11-15H2,1H3.
What are the key properties of N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide?
N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide has a molecular weight of 354.45 g/mol, XLogP of 1.95, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(2-morpholin-4-yl-4-pyridinyl)-N-(2-pyridin-2-ylethyl)propanamide is sourced from PubChem (CID 83273950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).