N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide

C13H17N3O2 — CID 109179845

IUPACN-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide
SMILESO=C(NC1CC1)c1ccc(N2CCOCC2)cn1
InChIInChI=1S/C13H17N3O2/c17-13(15-10-1-2-10)12-4-3-11(9-14-12)16-5-7-18-8-6-16/h3-4,9-10H,1-2,5-8H2,(H,15,17)
InChIKeyZUNLMCBTTPUKET-UHFFFAOYSA-N
MW247.30 g/mol
LogP0.81
Rot. Bonds3

About N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide

N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide (PubChem CID 109179845) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide
PubChem CID109179845
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC NameN-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide
SMILESO=C(NC1CC1)c1ccc(N2CCOCC2)cn1
InChIInChI=1S/C13H17N3O2/c17-13(15-10-1-2-10)12-4-3-11(9-14-12)16-5-7-18-8-6-16/h3-4,9-10H,1-2,5-8H2,(H,15,17)
InChIKeyZUNLMCBTTPUKET-UHFFFAOYSA-N
XLogP0.81
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide?
The IUPAC name of N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide (CID 109179845) is N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide is O=C(NC1CC1)c1ccc(N2CCOCC2)cn1.
What is the InChIKey of N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide?
The InChIKey is ZUNLMCBTTPUKET-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c17-13(15-10-1-2-10)12-4-3-11(9-14-12)16-5-7-18-8-6-16/h3-4,9-10H,1-2,5-8H2,(H,15,17).
What are the key properties of N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide?
N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide has a molecular weight of 247.30 g/mol, XLogP of 0.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 109179845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).