N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide

C19H22N2O3 — CID 119100066

IUPACN-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide
SMILESCCc1ccccc1NC(=O)c1ccc(OCC2CCCO2)nc1
InChIInChI=1S/C19H22N2O3/c1-2-14-6-3-4-8-17(14)21-19(22)15-9-10-18(20-12-15)24-13-16-7-5-11-23-16/h3-4,6,8-10,12,16H,2,5,7,11,13H2,1H3,(H,21,22)
InChIKeyUUAYRAWEBYNSRP-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.45
Rot. Bonds6

About N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide

N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide (PubChem CID 119100066) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide
PubChem CID119100066
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide
SMILESCCc1ccccc1NC(=O)c1ccc(OCC2CCCO2)nc1
InChIInChI=1S/C19H22N2O3/c1-2-14-6-3-4-8-17(14)21-19(22)15-9-10-18(20-12-15)24-13-16-7-5-11-23-16/h3-4,6,8-10,12,16H,2,5,7,11,13H2,1H3,(H,21,22)
InChIKeyUUAYRAWEBYNSRP-UHFFFAOYSA-N
XLogP3.45
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide (CID 119100066) is N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide is CCc1ccccc1NC(=O)c1ccc(OCC2CCCO2)nc1.
What is the InChIKey of N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide?
The InChIKey is UUAYRAWEBYNSRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-2-14-6-3-4-8-17(14)21-19(22)15-9-10-18(20-12-15)24-13-16-7-5-11-23-16/h3-4,6,8-10,12,16H,2,5,7,11,13H2,1H3,(H,21,22).
What are the key properties of N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide?
N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 3.45, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-6-(oxolan-2-ylmethoxy)pyridine-3-carboxamide is sourced from PubChem (CID 119100066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).