N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride

C13H20ClN3O2 — CID 2909951

IUPACN-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride
SMILESCl.O=C(NCCCN1CCOCC1)c1cccnc1
InChIInChI=1S/C13H19N3O2.ClH/c17-13(12-3-1-4-14-11-12)15-5-2-6-16-7-9-18-10-8-16;/h1,3-4,11H,2,5-10H2,(H,15,17);1H
InChIKeyARXLHYAJYAXLNU-UHFFFAOYSA-N
MW285.77 g/mol
LogP0.96
Rot. Bonds5

About N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride

N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride (PubChem CID 2909951) has the molecular formula C13H20ClN3O2 and a molecular weight of 285.77 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride
PubChem CID2909951
Molecular FormulaC13H20ClN3O2
Molecular Weight285.77 g/mol
Exact Mass285.12
IUPAC NameN-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride
SMILESCl.O=C(NCCCN1CCOCC1)c1cccnc1
InChIInChI=1S/C13H19N3O2.ClH/c17-13(12-3-1-4-14-11-12)15-5-2-6-16-7-9-18-10-8-16;/h1,3-4,11H,2,5-10H2,(H,15,17);1H
InChIKeyARXLHYAJYAXLNU-UHFFFAOYSA-N
XLogP0.96
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.77
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-N,4-N-bis(3-morpholin-4-ylpropyl)benzene-1,4-dicarboxamide;hydrochloride
CID 54609927
N-[3-(4-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide
CID 100628883
N-[5-(4-ethylpiperazin-1-yl)pentyl]pyridine-3-carboxamide
CID 110442851
N-[2-[[N-ethyl-N'-(2-morpholin-4-ylethyl)carbamimidoyl]amino]ethyl]pyridine-3-carboxamide
CID 111187375
2-N,5-N-bis(3-morpholin-4-ylpropyl)pyridine-2,5-dicarboxamide
CID 4595283
1-(3-morpholin-4-ylpropyl)-3-(pyridin-3-ylmethyl)urea
CID 127566290
3-hydroxy-N-(3-morpholin-4-ylpropyl)benzamide
CID 43236314
N-[2-(3-oxomorpholin-4-yl)ethyl]pyridine-3-carboxamide
CID 110722595
3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide
CID 105068500
N-(3-pyrrol-1-ylpropyl)pyridine-3-carboxamide
CID 90500651
N-(2-morpholin-4-ylethyl)-4-oxo-4-pyridin-3-ylbutanamide
CID 110408170
N-[2-(4-morpholin-4-ylbutanoyl)phenyl]pyridine-3-carboxamide
CID 157132607

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride?
The IUPAC name of N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride (CID 2909951) is N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride is Cl.O=C(NCCCN1CCOCC1)c1cccnc1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride?
The InChIKey is ARXLHYAJYAXLNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2.ClH/c17-13(12-3-1-4-14-11-12)15-5-2-6-16-7-9-18-10-8-16;/h1,3-4,11H,2,5-10H2,(H,15,17);1H.
What are the key properties of N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride?
N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride has a molecular weight of 285.77 g/mol, XLogP of 0.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide;hydrochloride is sourced from PubChem (CID 2909951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).