N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide

C18H22N4O2 — CID 91650790

IUPACN-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide
SMILESCc1ccc(CCNC(=O)c2cc(N3CCOCC3)ccn2)cn1
InChIInChI=1S/C18H22N4O2/c1-14-2-3-15(13-21-14)4-6-20-18(23)17-12-16(5-7-19-17)22-8-10-24-11-9-22/h2-3,5,7,12-13H,4,6,8-11H2,1H3,(H,20,23)
InChIKeyMIQWOURPMULIAT-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.59
Rot. Bonds5

About N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide

N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide (PubChem CID 91650790) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide
PubChem CID91650790
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC NameN-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide
SMILESCc1ccc(CCNC(=O)c2cc(N3CCOCC3)ccn2)cn1
InChIInChI=1S/C18H22N4O2/c1-14-2-3-15(13-21-14)4-6-20-18(23)17-12-16(5-7-19-17)22-8-10-24-11-9-22/h2-3,5,7,12-13H,4,6,8-11H2,1H3,(H,20,23)
InChIKeyMIQWOURPMULIAT-UHFFFAOYSA-N
XLogP1.59
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide?
The IUPAC name of N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide (CID 91650790) is N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide.
What is the SMILES notation for N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide?
The canonical SMILES for N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide is Cc1ccc(CCNC(=O)c2cc(N3CCOCC3)ccn2)cn1.
What is the InChIKey of N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide?
The InChIKey is MIQWOURPMULIAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-14-2-3-15(13-21-14)4-6-20-18(23)17-12-16(5-7-19-17)22-8-10-24-11-9-22/h2-3,5,7,12-13H,4,6,8-11H2,1H3,(H,20,23).
What are the key properties of N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide?
N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 1.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-methyl-3-pyridinyl)ethyl]-4-morpholin-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 91650790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).