5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide

C15H25N3O — CID 104641912

IUPAC5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NCCCCC(C)C)nc1
InChIInChI=1S/C15H25N3O/c1-4-16-13-8-9-14(18-11-13)15(19)17-10-6-5-7-12(2)3/h8-9,11-12,16H,4-7,10H2,1-3H3,(H,17,19)
InChIKeyZFDNAPFFEZANDC-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.07
Rot. Bonds8

About 5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide

5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide (PubChem CID 104641912) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide
PubChem CID104641912
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)NCCCCC(C)C)nc1
InChIInChI=1S/C15H25N3O/c1-4-16-13-8-9-14(18-11-13)15(19)17-10-6-5-7-12(2)3/h8-9,11-12,16H,4-7,10H2,1-3H3,(H,17,19)
InChIKeyZFDNAPFFEZANDC-UHFFFAOYSA-N
XLogP3.07
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-(butylamino)-N-(3-methylbutyl)pyridine-2-carboxamide
CID 109180889
5-(2-methylpropylamino)-N-pentylpyridine-2-carboxamide
CID 109181275
5-(ethylamino)-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide
CID 102908038
5-(ethylamino)-N-methylpyridine-2-carboxamide
CID 104639889
5-(ethylamino)-N-(4-imidazol-1-ylbutyl)pyridine-2-carboxamide
CID 104640721
N-(2-methoxyethyl)-5-(3-methylbutylamino)pyridine-2-carboxamide
CID 109183892
5-carbamothioyl-N-(7-methyloctyl)pyridine-2-carboxamide
CID 107815227
5-(ethylamino)-N-hexan-2-ylpyridine-2-carboxamide
CID 113436154
5-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 104639698
5-(methylamino)-N-[3-[methyl(propan-2-yl)amino]propyl]pyridine-2-carboxamide
CID 106050159
N-(3-methoxypropyl)-5-(3-methoxypropylamino)pyridine-2-carboxamide
CID 109184195
5-(ethylamino)-N-[2-(2-methylphenyl)ethyl]pyridine-2-carboxamide
CID 104641754

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide?
The IUPAC name of 5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide (CID 104641912) is 5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide is CCNc1ccc(C(=O)NCCCCC(C)C)nc1.
What is the InChIKey of 5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide?
The InChIKey is ZFDNAPFFEZANDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-16-13-8-9-14(18-11-13)15(19)17-10-6-5-7-12(2)3/h8-9,11-12,16H,4-7,10H2,1-3H3,(H,17,19).
What are the key properties of 5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide?
5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 3.07, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-N-(5-methylhexyl)pyridine-2-carboxamide is sourced from PubChem (CID 104641912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).