N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide

C14H20N2O3 — CID 90653439

IUPACN-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
SMILESCCN(CC1CCCCO1)C(=O)c1ccncc1O
InChIInChI=1S/C14H20N2O3/c1-2-16(10-11-5-3-4-8-19-11)14(18)12-6-7-15-9-13(12)17/h6-7,9,11,17H,2-5,8,10H2,1H3
InChIKeyREKHLBIAJOCTBM-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.82
Rot. Bonds4

About N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide

N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide (PubChem CID 90653439) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
PubChem CID90653439
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
SMILESCCN(CC1CCCCO1)C(=O)c1ccncc1O
InChIInChI=1S/C14H20N2O3/c1-2-16(10-11-5-3-4-8-19-11)14(18)12-6-7-15-9-13(12)17/h6-7,9,11,17H,2-5,8,10H2,1H3
InChIKeyREKHLBIAJOCTBM-UHFFFAOYSA-N
XLogP1.82
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-4-(methylamino)-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 81243061
N-ethyl-4-hydrazinyl-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 81256372
N-ethyl-2,3-difluoro-N-(oxolan-2-ylmethyl)pyridine-4-carboxamide
CID 114985398
N-ethyl-N-(oxan-2-ylmethyl)-2-pyridin-3-yloxyacetamide
CID 91841175
3-(ethylamino)-N-methyl-N-(oxan-2-ylmethyl)pyridine-4-carboxamide
CID 105068980
N,N-bis(cyclopropylmethyl)-3-hydroxypyridine-4-carboxamide
CID 81443103
4-chloro-N-ethyl-6-methyl-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 81226969
N-ethyl-2-(methylamino)-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 62179617
3-hydroxy-N-[2-(oxolan-2-yl)ethyl]pyridine-4-carboxamide
CID 80707090
N-ethyl-6-(methylamino)-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 62179784
N-ethyl-5-methyl-N-(oxan-2-ylmethyl)-1,3-oxazole-4-carboxamide
CID 131931546
6-amino-N-ethyl-N-(oxolan-2-ylmethyl)pyridine-3-carboxamide
CID 62161209

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide?
The IUPAC name of N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide (CID 90653439) is N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide.
What is the SMILES notation for N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide?
The canonical SMILES for N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide is CCN(CC1CCCCO1)C(=O)c1ccncc1O.
What is the InChIKey of N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide?
The InChIKey is REKHLBIAJOCTBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-2-16(10-11-5-3-4-8-19-11)14(18)12-6-7-15-9-13(12)17/h6-7,9,11,17H,2-5,8,10H2,1H3.
What are the key properties of N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide?
N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide has a molecular weight of 264.32 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-hydroxy-N-(oxan-2-ylmethyl)pyridine-4-carboxamide is sourced from PubChem (CID 90653439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).