N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide

C13H19N3O3 — CID 84574824

IUPACN-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide
SMILESCC(O)CNC(=O)c1ccnc(N2CCOCC2)c1
InChIInChI=1S/C13H19N3O3/c1-10(17)9-15-13(18)11-2-3-14-12(8-11)16-4-6-19-7-5-16/h2-3,8,10,17H,4-7,9H2,1H3,(H,15,18)
InChIKeyPJDQXRKIOAKQCY-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.03
Rot. Bonds4

About N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide

N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide (PubChem CID 84574824) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide
PubChem CID84574824
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide
SMILESCC(O)CNC(=O)c1ccnc(N2CCOCC2)c1
InChIInChI=1S/C13H19N3O3/c1-10(17)9-15-13(18)11-2-3-14-12(8-11)16-4-6-19-7-5-16/h2-3,8,10,17H,4-7,9H2,1H3,(H,15,18)
InChIKeyPJDQXRKIOAKQCY-UHFFFAOYSA-N
XLogP0.03
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide?
The IUPAC name of N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide (CID 84574824) is N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide.
What is the SMILES notation for N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide?
The canonical SMILES for N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide is CC(O)CNC(=O)c1ccnc(N2CCOCC2)c1.
What is the InChIKey of N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide?
The InChIKey is PJDQXRKIOAKQCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-10(17)9-15-13(18)11-2-3-14-12(8-11)16-4-6-19-7-5-16/h2-3,8,10,17H,4-7,9H2,1H3,(H,15,18).
What are the key properties of N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide?
N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide has a molecular weight of 265.31 g/mol, XLogP of 0.03, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-2-morpholin-4-ylpyridine-4-carboxamide is sourced from PubChem (CID 84574824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).