N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide

C14H22N4O2 — CID 84576380

IUPACN-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide
SMILESCN(C)CCNC(=O)c1cccnc1N1CCOCC1
InChIInChI=1S/C14H22N4O2/c1-17(2)7-6-16-14(19)12-4-3-5-15-13(12)18-8-10-20-11-9-18/h3-5H,6-11H2,1-2H3,(H,16,19)
InChIKeyDZZRMVZKEMEJCY-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.21
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide

N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide (PubChem CID 84576380) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide
PubChem CID84576380
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC NameN-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide
SMILESCN(C)CCNC(=O)c1cccnc1N1CCOCC1
InChIInChI=1S/C14H22N4O2/c1-17(2)7-6-16-14(19)12-4-3-5-15-13(12)18-8-10-20-11-9-18/h3-5H,6-11H2,1-2H3,(H,16,19)
InChIKeyDZZRMVZKEMEJCY-UHFFFAOYSA-N
XLogP0.21
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide (CID 84576380) is N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide is CN(C)CCNC(=O)c1cccnc1N1CCOCC1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide?
The InChIKey is DZZRMVZKEMEJCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-17(2)7-6-16-14(19)12-4-3-5-15-13(12)18-8-10-20-11-9-18/h3-5H,6-11H2,1-2H3,(H,16,19).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide?
N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 0.21, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-morpholin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 84576380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).