2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide

C13H19N3O2 — CID 82737205

IUPAC2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide
SMILESCCNc1ncccc1C(=O)NC1CCOC1C
InChIInChI=1S/C13H19N3O2/c1-3-14-12-10(5-4-7-15-12)13(17)16-11-6-8-18-9(11)2/h4-5,7,9,11H,3,6,8H2,1-2H3,(H,14,15)(H,16,17)
InChIKeyXJYYSSVGGTYWGK-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.42
Rot. Bonds4

About 2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide

2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide (PubChem CID 82737205) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide
PubChem CID82737205
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide
SMILESCCNc1ncccc1C(=O)NC1CCOC1C
InChIInChI=1S/C13H19N3O2/c1-3-14-12-10(5-4-7-15-12)13(17)16-11-6-8-18-9(11)2/h4-5,7,9,11H,3,6,8H2,1-2H3,(H,14,15)(H,16,17)
InChIKeyXJYYSSVGGTYWGK-UHFFFAOYSA-N
XLogP1.42
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-azabicyclo[2.2.2]octan-3-yl)-2-(ethylamino)pyridine-3-carboxamide
CID 62167440
N-(1,1-dioxothian-4-yl)-2-(ethylamino)pyridine-3-carboxamide
CID 62169938
3-hydroxy-2-methyl-N-(2-methyloxolan-3-yl)benzamide
CID 82829597
N-(dicyclopropylmethyl)-2-(ethylamino)pyridine-3-carboxamide
CID 62178341
N-(2,2-dimethylcyclohexyl)-2-(ethylamino)pyridine-3-carboxamide
CID 79872423
2-iodo-N-(2-methyloxolan-3-yl)benzamide
CID 82728917
N-(1-cyclopropylpyrrolidin-3-yl)-2-(ethylamino)pyridine-3-carboxamide
CID 62173888
2-(ethylamino)-N-[(1-methylpyrrolidin-3-yl)methyl]pyridine-3-carboxamide
CID 62181266
N-[2-[cyclopropyl(methyl)amino]ethyl]-2-(ethylamino)pyridine-3-carboxamide
CID 62978746
[2-(ethylamino)-3-pyridinyl]-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)methanone
CID 66370320
2-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-3-carboxamide
CID 62179768
2-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridine-3-carboxamide
CID 62168328

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide?
The IUPAC name of 2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide (CID 82737205) is 2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide is CCNc1ncccc1C(=O)NC1CCOC1C.
What is the InChIKey of 2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide?
The InChIKey is XJYYSSVGGTYWGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-3-14-12-10(5-4-7-15-12)13(17)16-11-6-8-18-9(11)2/h4-5,7,9,11H,3,6,8H2,1-2H3,(H,14,15)(H,16,17).
What are the key properties of 2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide?
2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 1.42, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 82737205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).