3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide

C15H23N3O2 — CID 105068980

IUPAC3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
SMILESCCNc1cnccc1C(=O)N(C)CC1CCCCO1
InChIInChI=1S/C15H23N3O2/c1-3-17-14-10-16-8-7-13(14)15(19)18(2)11-12-6-4-5-9-20-12/h7-8,10,12,17H,3-6,9,11H2,1-2H3
InChIKeyNJBWIHGALMLTPA-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.15
Rot. Bonds5

About 3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide

3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide (PubChem CID 105068980) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
PubChem CID105068980
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
SMILESCCNc1cnccc1C(=O)N(C)CC1CCCCO1
InChIInChI=1S/C15H23N3O2/c1-3-17-14-10-16-8-7-13(14)15(19)18(2)11-12-6-4-5-9-20-12/h7-8,10,12,17H,3-6,9,11H2,1-2H3
InChIKeyNJBWIHGALMLTPA-UHFFFAOYSA-N
XLogP2.15
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(ethylamino)-N-methyl-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 105069188
2-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-3-carboxamide
CID 62179768
N-methyl-2-(methylamino)-N-(oxan-2-ylmethyl)benzamide
CID 61436480
N-methyl-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 110733149
3-(ethylamino)-N-[(1-hydroxycyclopentyl)methyl]-N-methylpyridine-4-carboxamide
CID 105071494
5-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyrazine-2-carboxamide
CID 107374782
N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
CID 90653439
3-fluoro-N-methyl-N-[2-[(2R)-oxan-2-yl]ethyl]pyridine-4-carboxamide
CID 99972449
3-fluoro-2-hydrazinyl-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
CID 105387899
4-(ethylamino)-N-[2-(oxolan-2-yl)ethyl]pyridine-3-carboxamide
CID 81240671
N-(oxolan-2-ylmethyl)-3-(propylamino)pyridine-4-carboxamide
CID 105068089
5-chloro-2-(ethylamino)-N-methyl-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 114922760

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide?
The IUPAC name of 3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide (CID 105068980) is 3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide?
The canonical SMILES for 3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide is CCNc1cnccc1C(=O)N(C)CC1CCCCO1.
What is the InChIKey of 3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide?
The InChIKey is NJBWIHGALMLTPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-17-14-10-16-8-7-13(14)15(19)18(2)11-12-6-4-5-9-20-12/h7-8,10,12,17H,3-6,9,11H2,1-2H3.
What are the key properties of 3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide?
3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide is sourced from PubChem (CID 105068980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).