N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide

C14H18N2O3 — CID 171414093

IUPACN-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide
SMILESCC(C)C(=O)CCC(=O)CNC(=O)c1cccnc1
InChIInChI=1S/C14H18N2O3/c1-10(2)13(18)6-5-12(17)9-16-14(19)11-4-3-7-15-8-11/h3-4,7-8,10H,5-6,9H2,1-2H3,(H,16,19)
InChIKeyUIEUDJLDSBLYQH-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.39
Rot. Bonds7

About N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide

N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide (PubChem CID 171414093) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide
PubChem CID171414093
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC NameN-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide
SMILESCC(C)C(=O)CCC(=O)CNC(=O)c1cccnc1
InChIInChI=1S/C14H18N2O3/c1-10(2)13(18)6-5-12(17)9-16-14(19)11-4-3-7-15-8-11/h3-4,7-8,10H,5-6,9H2,1-2H3,(H,16,19)
InChIKeyUIEUDJLDSBLYQH-UHFFFAOYSA-N
XLogP1.39
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methylbutan-2-yl 2-(pyridine-3-carbonylamino)acetate
CID 171414103
N-[(2S)-2-hydroxypropyl]pyridine-3-carboxamide
CID 39237258
N-[2-oxo-2-[[(1S)-1-pyridin-3-ylethyl]amino]ethyl]pyridine-3-carboxamide
CID 166223531
2-methyl-3-(pyridine-3-carbonylamino)propanoic acid
CID 53211442
N-(propan-2-yloxymethyl)pyridine-3-carboxamide
CID 3794279
N-[2-(propan-2-ylamino)ethyl]pyridine-3-carboxamide
CID 4235481
N-(2-hydrazinyl-2-oxoethyl)pyridine-3-carboxamide
CID 39070404
N-(2-phenylpropyl)pyridine-3-carboxamide
CID 46446505
N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 110705464
N-propan-2-yloxypyridine-3-carboxamide;hydrochloride
CID 3028390
N-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]pyridine-3-carboxamide
CID 110705497
N-methylpyridine-3-carboxamide chloride
CID 20976730

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide?
The IUPAC name of N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide (CID 171414093) is N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide?
The canonical SMILES for N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide is CC(C)C(=O)CCC(=O)CNC(=O)c1cccnc1.
What is the InChIKey of N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide?
The InChIKey is UIEUDJLDSBLYQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-10(2)13(18)6-5-12(17)9-16-14(19)11-4-3-7-15-8-11/h3-4,7-8,10H,5-6,9H2,1-2H3,(H,16,19).
What are the key properties of N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide?
N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 1.39, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2,5-dioxoheptyl)pyridine-3-carboxamide is sourced from PubChem (CID 171414093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).