4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide

C13H19N3O3 — CID 115293923

IUPAC4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide
SMILESCCOc1ncccc1NC(=O)C1(N)CCOCC1
InChIInChI=1S/C13H19N3O3/c1-2-19-11-10(4-3-7-15-11)16-12(17)13(14)5-8-18-9-6-13/h3-4,7H,2,5-6,8-9,14H2,1H3,(H,16,17)
InChIKeyRPAYMMRVYCIHJQ-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.93
Rot. Bonds4

About 4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide

4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide (PubChem CID 115293923) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide
PubChem CID115293923
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide
SMILESCCOc1ncccc1NC(=O)C1(N)CCOCC1
InChIInChI=1S/C13H19N3O3/c1-2-19-11-10(4-3-7-15-11)16-12(17)13(14)5-8-18-9-6-13/h3-4,7H,2,5-6,8-9,14H2,1H3,(H,16,17)
InChIKeyRPAYMMRVYCIHJQ-UHFFFAOYSA-N
XLogP0.93
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-N-(2-ethoxy-3-pyridinyl)oxolane-3-carboxamide
CID 64893957
1-amino-N-(2-ethoxy-3-pyridinyl)cyclopropane-1-carboxamide
CID 65467015
3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide
CID 64891921
4-amino-N-(2-chloro-3-pyridinyl)oxane-4-carboxamide
CID 113280621
4-amino-N-(2-ethoxy-4-methylphenyl)oxane-4-carboxamide
CID 115294126
4-amino-N-pyrimidin-2-yloxane-4-carboxamide
CID 115293590
1-amino-N-(2-ethoxyphenyl)cyclopropane-1-carboxamide
CID 65463762
N-(2-ethoxy-3-pyridinyl)-3-ethylpiperidine-3-carboxamide
CID 63130921
2-amino-N-(2-ethoxy-3-pyridinyl)-2-ethylbutanamide
CID 79809690
2-amino-N-(2-ethoxy-3-pyridinyl)-4-methylpentanamide
CID 43706630
(2S)-2-amino-N-(2-ethoxy-3-pyridinyl)-4-methylpentanamide
CID 61178380
3-amino-N-[2-(ethoxymethyl)phenyl]oxolane-3-carboxamide
CID 64891108

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide?
The IUPAC name of 4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide (CID 115293923) is 4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide.
What is the SMILES notation for 4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide?
The canonical SMILES for 4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide is CCOc1ncccc1NC(=O)C1(N)CCOCC1.
What is the InChIKey of 4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide?
The InChIKey is RPAYMMRVYCIHJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-2-19-11-10(4-3-7-15-11)16-12(17)13(14)5-8-18-9-6-13/h3-4,7H,2,5-6,8-9,14H2,1H3,(H,16,17).
What are the key properties of 4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide?
4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide has a molecular weight of 265.31 g/mol, XLogP of 0.93, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-ethoxy-3-pyridinyl)oxane-4-carboxamide is sourced from PubChem (CID 115293923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).