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

C15H25N3O — CID 106027853

IUPAC4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide
SMILESCCCCC(CCC)NC(=O)c1cc(NC)ccn1
InChIInChI=1S/C15H25N3O/c1-4-6-8-12(7-5-2)18-15(19)14-11-13(16-3)9-10-17-14/h9-12H,4-8H2,1-3H3,(H,16,17)(H,18,19)
InChIKeyAWTBJPORDXRAQT-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.21
Rot. Bonds8

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

4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide (PubChem CID 106027853) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide
PubChem CID106027853
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide
SMILESCCCCC(CCC)NC(=O)c1cc(NC)ccn1
InChIInChI=1S/C15H25N3O/c1-4-6-8-12(7-5-2)18-15(19)14-11-13(16-3)9-10-17-14/h9-12H,4-8H2,1-3H3,(H,16,17)(H,18,19)
InChIKeyAWTBJPORDXRAQT-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-octan-4-ylpyridine-2-carboxamide
CID 106027811
N-hexan-2-yl-4-hydrazinylpyridine-2-carboxamide
CID 62237642
N-(3-ethylpentan-2-yl)-4-(methylamino)pyridine-2-carboxamide
CID 63838456
N-(2-butoxyethyl)-4-(methylamino)pyridine-2-carboxamide
CID 62177424
N-pentan-2-yl-4-(propylamino)pyridine-2-carboxamide
CID 62185598
5-methyl-2-(methylamino)-N-octan-4-ylbenzamide
CID 106027859
N-ethyl-4-(hexan-2-ylamino)pyridine-2-carboxamide
CID 62200054
N-butan-2-yl-4-(butylamino)pyridine-2-carboxamide
CID 109202657
3,5-difluoro-4-(methylamino)-N-octan-4-ylbenzamide
CID 106027843
6-(ethylamino)-N-octan-4-ylpyridazine-3-carboxamide
CID 106027867
4-(methylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-2-carboxamide
CID 62178459
5-hydrazinyl-N-octan-4-ylpyrazine-2-carboxamide
CID 106025870

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide?
The IUPAC name of 4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide (CID 106027853) is 4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide.
What is the SMILES notation for 4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide?
The canonical SMILES for 4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide is CCCCC(CCC)NC(=O)c1cc(NC)ccn1.
What is the InChIKey of 4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide?
The InChIKey is AWTBJPORDXRAQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-6-8-12(7-5-2)18-15(19)14-11-13(16-3)9-10-17-14/h9-12H,4-8H2,1-3H3,(H,16,17)(H,18,19).
What are the key properties of 4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide?
4-(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 4-(methylamino)-N-octan-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 106027853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).