5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide

C14H18N4O2 — CID 63717300

IUPAC5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(C(=O)NCCCN2CCOCC2)nc1
InChIInChI=1S/C14H18N4O2/c15-10-12-2-3-13(17-11-12)14(19)16-4-1-5-18-6-8-20-9-7-18/h2-3,11H,1,4-9H2,(H,16,19)
InChIKeyODACIULOCIOGSA-UHFFFAOYSA-N
MW274.32 g/mol
LogP0.41
Rot. Bonds5

About 5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide

5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide (PubChem CID 63717300) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide
PubChem CID63717300
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(C(=O)NCCCN2CCOCC2)nc1
InChIInChI=1S/C14H18N4O2/c15-10-12-2-3-13(17-11-12)14(19)16-4-1-5-18-6-8-20-9-7-18/h2-3,11H,1,4-9H2,(H,16,19)
InChIKeyODACIULOCIOGSA-UHFFFAOYSA-N
XLogP0.41
TPSA78.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-N,5-N-bis(3-morpholin-4-ylpropyl)pyridine-2,5-dicarboxamide
CID 4595283
methyl 1-[3-[(5-cyanopyridine-2-carbonyl)amino]propyl]piperidine-4-carboxylate
CID 166187744
5-cyano-N-(2-piperazin-1-ylethyl)pyridine-2-carboxamide
CID 63724069
N-(3-morpholin-4-ylpropyl)pyrimidine-4-carboxamide
CID 141309481
5-carbamothioyl-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide
CID 63724916
5-(4-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 109277590
5-cyano-N-(3-iodopropyl)pyridine-2-carboxamide
CID 114504454
5-cyano-N-(3-methylsulfonylpropyl)pyridine-2-carboxamide
CID 63716783
N-(5-amino-5-oxopentyl)-5-cyanopyridine-2-carboxamide
CID 103896383
6-N-(4-cyanophenyl)-2-N-(2-morpholin-4-ylethyl)pyridine-2,6-dicarboxamide
CID 109096501
5-cyano-N-[3-(diethylamino)propyl]pyridine-2-carboxamide
CID 63722909
5-cyano-N-(4-hydroxypentyl)pyridine-2-carboxamide
CID 107300157

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide?
The IUPAC name of 5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide (CID 63717300) is 5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide is N#Cc1ccc(C(=O)NCCCN2CCOCC2)nc1.
What is the InChIKey of 5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide?
The InChIKey is ODACIULOCIOGSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c15-10-12-2-3-13(17-11-12)14(19)16-4-1-5-18-6-8-20-9-7-18/h2-3,11H,1,4-9H2,(H,16,19).
What are the key properties of 5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide?
5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 0.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-(3-morpholin-4-ylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 63717300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).