N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide

C14H17N3O2 — CID 110686207

IUPACN-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide
SMILESCCN(CCc1ccncc1)C(=O)c1ocnc1C
InChIInChI=1S/C14H17N3O2/c1-3-17(9-6-12-4-7-15-8-5-12)14(18)13-11(2)16-10-19-13/h4-5,7-8,10H,3,6,9H2,1-2H3
InChIKeyGPIHSTSYQPQYMJ-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.08
Rot. Bonds5

About N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide

N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide (PubChem CID 110686207) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide
PubChem CID110686207
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide
SMILESCCN(CCc1ccncc1)C(=O)c1ocnc1C
InChIInChI=1S/C14H17N3O2/c1-3-17(9-6-12-4-7-15-8-5-12)14(18)13-11(2)16-10-19-13/h4-5,7-8,10H,3,6,9H2,1-2H3
InChIKeyGPIHSTSYQPQYMJ-UHFFFAOYSA-N
XLogP2.08
TPSA59.23 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,N,N'-triethyl-N'-(2-pyridin-4-ylethyl)oxamide
CID 108526067
N-ethyl-N-(2-pyridin-4-ylethyl)pentanamide
CID 110755648
2-bromo-N-ethyl-N-(2-pyridin-4-ylethyl)benzamide
CID 110755663
3,4-diamino-N-ethyl-N-(2-pyridin-4-ylethyl)benzamide
CID 82183845
N-ethyl-5-oxo-N-(2-pyridin-4-ylethyl)-1,2-dihydropyrazole-3-carboxamide
CID 110600687
4-acetamido-N-ethyl-N-(2-pyridin-4-ylethyl)benzamide
CID 110757168
3-acetamido-N-ethyl-N-(2-pyridin-4-ylethyl)benzamide
CID 110757164
N-ethyl-2-(4-methyl-1,3-thiazol-5-yl)-N-(2-pyridin-4-ylethyl)acetamide
CID 110679621
3-amino-N-ethyl-N-(2-pyridin-4-ylethyl)propanamide
CID 22692037
3-(cyanomethyl)-1-ethyl-1-(2-pyridin-4-ylethyl)urea
CID 108864796
N'-ethyl-N-pentyl-N'-(2-pyridin-4-ylethyl)oxamide
CID 108521696
N-ethyl-6-oxo-N-(2-pyridin-4-ylethyl)-1H-pyridazine-3-carboxamide
CID 110704750

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide?
The IUPAC name of N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide (CID 110686207) is N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide is CCN(CCc1ccncc1)C(=O)c1ocnc1C.
What is the InChIKey of N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide?
The InChIKey is GPIHSTSYQPQYMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-3-17(9-6-12-4-7-15-8-5-12)14(18)13-11(2)16-10-19-13/h4-5,7-8,10H,3,6,9H2,1-2H3.
What are the key properties of N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide?
N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 2.08, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-N-(2-pyridin-4-ylethyl)-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 110686207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).