N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide

C13H20N2O2 — CID 113232040

IUPACN-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide
SMILESCCC(CC)CNC(=O)c1ccc(OC)nc1
InChIInChI=1S/C13H20N2O2/c1-4-10(5-2)8-15-13(16)11-6-7-12(17-3)14-9-11/h6-7,9-10H,4-5,8H2,1-3H3,(H,15,16)
InChIKeyKITZZDJIEAABRQ-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.26
Rot. Bonds6

About N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide

N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide (PubChem CID 113232040) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide
PubChem CID113232040
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide
SMILESCCC(CC)CNC(=O)c1ccc(OC)nc1
InChIInChI=1S/C13H20N2O2/c1-4-10(5-2)8-15-13(16)11-6-7-12(17-3)14-9-11/h6-7,9-10H,4-5,8H2,1-3H3,(H,15,16)
InChIKeyKITZZDJIEAABRQ-UHFFFAOYSA-N
XLogP2.26
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methoxy-N-(3-methyl-2-propan-2-ylbutyl)pyridine-3-carboxamide
CID 102914743
N-(2-ethylbutyl)-6-methylpyridine-3-carboxamide
CID 115612931
N-(2-ethyl-2-hydroxybutyl)-6-methoxypyridine-3-carboxamide
CID 65112036
6-methoxy-N-[(2S)-2-piperidin-1-ylpropyl]pyridine-3-carboxamide
CID 94633091
N-(3-hydroxy-4-methoxybutyl)-6-methoxypyridine-3-carboxamide
CID 103877604
N-(1-hydroxypentan-3-yl)-6-methoxypyridine-3-carboxamide
CID 115767344
2-[2-[(6-methoxypyridine-3-carbonyl)amino]ethylsulfanyl]acetic acid
CID 119241900
N-(4-bromo-2-ethylbutyl)-6-methylpyridine-3-carboxamide
CID 114317633
1-N,4-N-bis[(6-methoxy-3-pyridinyl)methyl]benzene-1,4-dicarboxamide
CID 24646071
6-methoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 27548743
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-6-methoxypyridine-3-carboxamide
CID 107845114
N-[2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-6-ethoxypyridine-3-carboxamide
CID 87002114

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide?
The IUPAC name of N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide (CID 113232040) is N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide?
The canonical SMILES for N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide is CCC(CC)CNC(=O)c1ccc(OC)nc1.
What is the InChIKey of N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide?
The InChIKey is KITZZDJIEAABRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-10(5-2)8-15-13(16)11-6-7-12(17-3)14-9-11/h6-7,9-10H,4-5,8H2,1-3H3,(H,15,16).
What are the key properties of N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide?
N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide has a molecular weight of 236.31 g/mol, XLogP of 2.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylbutyl)-6-methoxypyridine-3-carboxamide is sourced from PubChem (CID 113232040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).