N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide

C15H25N3O2 — CID 109228070

IUPACN-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide
SMILESCCCCCNc1cncc(C(=O)NCCCOC)c1
InChIInChI=1S/C15H25N3O2/c1-3-4-5-7-17-14-10-13(11-16-12-14)15(19)18-8-6-9-20-2/h10-12,17H,3-9H2,1-2H3,(H,18,19)
InChIKeyRAULCGAADJWLMO-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.45
Rot. Bonds10

About N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide

N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide (PubChem CID 109228070) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide
PubChem CID109228070
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide
SMILESCCCCCNc1cncc(C(=O)NCCCOC)c1
InChIInChI=1S/C15H25N3O2/c1-3-4-5-7-17-14-10-13(11-16-12-14)15(19)18-8-6-9-20-2/h10-12,17H,3-9H2,1-2H3,(H,18,19)
InChIKeyRAULCGAADJWLMO-UHFFFAOYSA-N
XLogP2.45
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-5-(propylamino)pyridine-3-carboxamide
CID 109222970
5-(butylamino)-N-propylpyridine-3-carboxamide
CID 109222762
5-(3-methoxypropylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109223169
N-[2-(4-fluorophenyl)ethyl]-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109228217
5-[(2-fluorophenyl)methylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109228022
N-butan-2-yl-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109225122
N-[2-(3-methoxyphenyl)ethyl]-5-(pentylamino)pyridine-3-carboxamide
CID 109236721
5-[2-(3-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109228038
5-[2-(2-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109228037
5-[(4-chlorophenyl)methylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109228025
5-(3,4-difluoroanilino)-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109228185
5-hydroxy-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 63865493

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide (CID 109228070) is N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide is CCCCCNc1cncc(C(=O)NCCCOC)c1.
What is the InChIKey of N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide?
The InChIKey is RAULCGAADJWLMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-3-4-5-7-17-14-10-13(11-16-12-14)15(19)18-8-6-9-20-2/h10-12,17H,3-9H2,1-2H3,(H,18,19).
What are the key properties of N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide?
N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide has a molecular weight of 279.38 g/mol, XLogP of 2.45, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-5-(pentylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109228070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).