5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide

C15H25N3O — CID 106027811

IUPAC5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide
SMILESCCCCC(CCC)NC(=O)c1ccc(NC)cn1
InChIInChI=1S/C15H25N3O/c1-4-6-8-12(7-5-2)18-15(19)14-10-9-13(16-3)11-17-14/h9-12,16H,4-8H2,1-3H3,(H,18,19)
InChIKeyBYFVQGLPGIASTN-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.21
Rot. Bonds8

About 5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide

5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide (PubChem CID 106027811) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide
PubChem CID106027811
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide
SMILESCCCCC(CCC)NC(=O)c1ccc(NC)cn1
InChIInChI=1S/C15H25N3O/c1-4-6-8-12(7-5-2)18-15(19)14-10-9-13(16-3)11-17-14/h9-12,16H,4-8H2,1-3H3,(H,18,19)
InChIKeyBYFVQGLPGIASTN-UHFFFAOYSA-N
XLogP3.21
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 ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(methylamino)-N-pentan-3-ylpyridine-2-carboxamide
CID 104639887
4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide
CID 106027853
5-(ethylamino)-N-hexan-2-ylpyridine-2-carboxamide
CID 113436154
5-(methylamino)-N-(3-methylpentan-2-yl)pyridine-2-carboxamide
CID 104640576
5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide
CID 106025870
6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide
CID 106027867
N-octan-4-yl-6-(propylamino)pyridazine-3-carboxamide
CID 106027845
N-octan-2-yl-5-(propylamino)pyridine-2-carboxamide
CID 104640604
N-(4-ethoxyphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104639683
N-(dicyclopropylmethyl)-5-(methylamino)pyridine-2-carboxamide
CID 113436148
5-chloro-N-(1-hydroxyhexan-2-yl)pyrazine-2-carboxamide
CID 122604026
N-butan-2-yl-5-(butylamino)pyridine-2-carboxamide
CID 109180814

Frequently Asked Questions

What is the IUPAC name of 5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide?
The IUPAC name of 5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide (CID 106027811) is 5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide.
What is the SMILES notation for 5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide?
The canonical SMILES for 5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide is CCCCC(CCC)NC(=O)c1ccc(NC)cn1.
What is the InChIKey of 5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide?
The InChIKey is BYFVQGLPGIASTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-6-8-12(7-5-2)18-15(19)14-10-9-13(16-3)11-17-14/h9-12,16H,4-8H2,1-3H3,(H,18,19).
What are the key properties of 5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide?
5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 3.21, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylamino)-N-octan-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 106027811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).